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structures/1qzb.cif ADDED
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1
+ data_1QZB
2
+ #
3
+ _entry.id 1QZB
4
+ #
5
+ _audit_conform.dict_name mmcif_pdbx.dic
6
+ _audit_conform.dict_version 5.386
7
+ _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic
8
+ #
9
+ loop_
10
+ _database_2.database_id
11
+ _database_2.database_code
12
+ _database_2.pdbx_database_accession
13
+ _database_2.pdbx_DOI
14
+ PDB 1QZB pdb_00001qzb 10.2210/pdb1qzb/pdb
15
+ RCSB RCSB020252 ? ?
16
+ WWPDB D_1000020252 ? ?
17
+ #
18
+ loop_
19
+ _pdbx_audit_revision_history.ordinal
20
+ _pdbx_audit_revision_history.data_content_type
21
+ _pdbx_audit_revision_history.major_revision
22
+ _pdbx_audit_revision_history.minor_revision
23
+ _pdbx_audit_revision_history.revision_date
24
+ 1 'Structure model' 1 0 2003-11-04
25
+ 2 'Structure model' 1 1 2008-04-29
26
+ 3 'Structure model' 1 2 2011-07-13
27
+ 4 'Structure model' 1 3 2024-02-14
28
+ #
29
+ _pdbx_audit_revision_details.ordinal 1
30
+ _pdbx_audit_revision_details.revision_ordinal 1
31
+ _pdbx_audit_revision_details.data_content_type 'Structure model'
32
+ _pdbx_audit_revision_details.provider repository
33
+ _pdbx_audit_revision_details.type 'Initial release'
34
+ _pdbx_audit_revision_details.description ?
35
+ _pdbx_audit_revision_details.details ?
36
+ #
37
+ loop_
38
+ _pdbx_audit_revision_group.ordinal
39
+ _pdbx_audit_revision_group.revision_ordinal
40
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41
+ _pdbx_audit_revision_group.group
42
+ 1 2 'Structure model' 'Version format compliance'
43
+ 2 3 'Structure model' 'Version format compliance'
44
+ 3 4 'Structure model' 'Data collection'
45
+ 4 4 'Structure model' 'Database references'
46
+ 5 4 'Structure model' 'Refinement description'
47
+ #
48
+ loop_
49
+ _pdbx_audit_revision_category.ordinal
50
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51
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52
+ _pdbx_audit_revision_category.category
53
+ 1 4 'Structure model' chem_comp_atom
54
+ 2 4 'Structure model' chem_comp_bond
55
+ 3 4 'Structure model' database_2
56
+ 4 4 'Structure model' em_3d_fitting_list
57
+ 5 4 'Structure model' em_image_scans
58
+ 6 4 'Structure model' pdbx_initial_refinement_model
59
+ #
60
+ loop_
61
+ _pdbx_audit_revision_item.ordinal
62
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63
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64
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65
+ 1 4 'Structure model' '_database_2.pdbx_DOI'
66
+ 2 4 'Structure model' '_database_2.pdbx_database_accession'
67
+ 3 4 'Structure model' '_em_3d_fitting_list.accession_code'
68
+ 4 4 'Structure model' '_em_3d_fitting_list.initial_refinement_model_id'
69
+ 5 4 'Structure model' '_em_3d_fitting_list.source_name'
70
+ 6 4 'Structure model' '_em_3d_fitting_list.type'
71
+ #
72
+ _pdbx_database_status.status_code REL
73
+ _pdbx_database_status.entry_id 1QZB
74
+ _pdbx_database_status.recvd_initial_deposition_date 2003-09-16
75
+ _pdbx_database_status.deposit_site RCSB
76
+ _pdbx_database_status.process_site RCSB
77
+ _pdbx_database_status.SG_entry .
78
+ _pdbx_database_status.status_code_sf ?
79
+ _pdbx_database_status.status_code_mr ?
80
+ _pdbx_database_status.pdb_format_compatible Y
81
+ _pdbx_database_status.status_code_cs ?
82
+ _pdbx_database_status.status_code_nmr_data ?
83
+ _pdbx_database_status.methods_development_category ?
84
+ #
85
+ loop_
86
+ _pdbx_database_related.db_name
87
+ _pdbx_database_related.db_id
88
+ _pdbx_database_related.details
89
+ _pdbx_database_related.content_type
90
+ PDB 1OB2 'E. coli elongation factor EF-Tu complexed with the antibiotic kirromycin, a GTP analog, and Phe-tRNA' unspecified
91
+ PDB 1QZA
92
+ 'Coordinates of the A/T site tRNA model fitted into the cryo-EM map of EF-Tu ternary complex (GDP.Kirromycin) bound 70S ribosome'
93
+ unspecified
94
+ PDB 1QZC
95
+ ;Coordinates of S12, SH44, LH69 and SRL separately fitted into the cryo-EM map of EF-Tu ternary complex (GDP.Kirromycin) bound 70S ribosome
96
+ ;
97
+ unspecified
98
+ PDB 1QZD
99
+ 'EF-Tu.kirromycin coordinates fitted into the cryo-EM map of EF-Tu ternary complex (GDP.Kirromycin) bound 70S ribosome'
100
+ unspecified
101
+ PDB 1R2W 'COORDINATES OF L11 WITH 58NTS OF 23S RRNA FITTED INTO THE CRYO-EM MAP OF THE 70S RIBOSOME' unspecified
102
+ PDB 1R2X
103
+ 'COORDINATES OF L11 WITH 58NTS OF 23S RRNA FITTED INTO THE CRYO-EM MAP OF EF-TU TERNARY COMPLEX (GDP.KIRROMYCIN) BOUND 70S RIBOSOME'
104
+ unspecified
105
+ EMDB EMD-1056 . 'associated EM volume'
106
+ #
107
+ loop_
108
+ _audit_author.name
109
+ _audit_author.pdbx_ordinal
110
+ 'Valle, M.' 1
111
+ 'Zavialov, A.' 2
112
+ 'Li, W.' 3
113
+ 'Stagg, S.M.' 4
114
+ 'Sengupta, J.' 5
115
+ 'Nielsen, R.C.' 6
116
+ 'Nissen, P.' 7
117
+ 'Harvey, S.C.' 8
118
+ 'Ehrenberg, M.' 9
119
+ 'Frank, J.' 10
120
+ #
121
+ _citation.id primary
122
+ _citation.title 'Incorporation of Aminoacyl-tRNA into the Ribosome as seen by Cryo-electron Microscopy'
123
+ _citation.journal_abbrev Nat.Struct.Biol.
124
+ _citation.journal_volume 10
125
+ _citation.page_first 899
126
+ _citation.page_last 906
127
+ _citation.year 2003
128
+ _citation.journal_id_ASTM NSBIEW
129
+ _citation.country US
130
+ _citation.journal_id_ISSN 1072-8368
131
+ _citation.journal_id_CSD 2024
132
+ _citation.book_publisher ?
133
+ _citation.pdbx_database_id_PubMed 14566331
134
+ _citation.pdbx_database_id_DOI 10.1038/nsb1003
135
+ #
136
+ loop_
137
+ _citation_author.citation_id
138
+ _citation_author.name
139
+ _citation_author.ordinal
140
+ _citation_author.identifier_ORCID
141
+ primary 'Valle, M.' 1 ?
142
+ primary 'Zavialov, A.' 2 ?
143
+ primary 'Li, W.' 3 ?
144
+ primary 'Stagg, S.M.' 4 ?
145
+ primary 'Sengupta, J.' 5 ?
146
+ primary 'Nielsen, R.C.' 6 ?
147
+ primary 'Nissen, P.' 7 ?
148
+ primary 'Harvey, S.C.' 8 ?
149
+ primary 'Ehrenberg, M.' 9 ?
150
+ primary 'Frank, J.' 10 ?
151
+ #
152
+ _entity.id 1
153
+ _entity.type polymer
154
+ _entity.src_method syn
155
+ _entity.pdbx_description Phe-tRNA
156
+ _entity.formula_weight 24518.570
157
+ _entity.pdbx_number_of_molecules 1
158
+ _entity.pdbx_ec ?
159
+ _entity.pdbx_mutation ?
160
+ _entity.pdbx_fragment ?
161
+ _entity.details ?
162
+ #
163
+ _entity_poly.entity_id 1
164
+ _entity_poly.type polyribonucleotide
165
+ _entity_poly.nstd_linkage no
166
+ _entity_poly.nstd_monomer no
167
+ _entity_poly.pdbx_seq_one_letter_code GCGGAUUUAGCUCAGUUGGGAGAGCGCCAGACUGAAGAUCUGGAGGUCCUGUGUUCGAUCCACAGAAUUCGCACCA
168
+ _entity_poly.pdbx_seq_one_letter_code_can GCGGAUUUAGCUCAGUUGGGAGAGCGCCAGACUGAAGAUCUGGAGGUCCUGUGUUCGAUCCACAGAAUUCGCACCA
169
+ _entity_poly.pdbx_strand_id B
170
+ _entity_poly.pdbx_target_identifier ?
171
+ #
172
+ loop_
173
+ _entity_poly_seq.entity_id
174
+ _entity_poly_seq.num
175
+ _entity_poly_seq.mon_id
176
+ _entity_poly_seq.hetero
177
+ 1 1 G n
178
+ 1 2 C n
179
+ 1 3 G n
180
+ 1 4 G n
181
+ 1 5 A n
182
+ 1 6 U n
183
+ 1 7 U n
184
+ 1 8 U n
185
+ 1 9 A n
186
+ 1 10 G n
187
+ 1 11 C n
188
+ 1 12 U n
189
+ 1 13 C n
190
+ 1 14 A n
191
+ 1 15 G n
192
+ 1 16 U n
193
+ 1 17 U n
194
+ 1 18 G n
195
+ 1 19 G n
196
+ 1 20 G n
197
+ 1 21 A n
198
+ 1 22 G n
199
+ 1 23 A n
200
+ 1 24 G n
201
+ 1 25 C n
202
+ 1 26 G n
203
+ 1 27 C n
204
+ 1 28 C n
205
+ 1 29 A n
206
+ 1 30 G n
207
+ 1 31 A n
208
+ 1 32 C n
209
+ 1 33 U n
210
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211
+ 1 35 A n
212
+ 1 36 A n
213
+ 1 37 G n
214
+ 1 38 A n
215
+ 1 39 U n
216
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217
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218
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219
+ 1 43 G n
220
+ 1 44 A n
221
+ 1 45 G n
222
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223
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224
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225
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226
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227
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228
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229
+ 1 53 G n
230
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231
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232
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233
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234
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235
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236
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237
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238
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239
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240
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241
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242
+ 1 66 A n
243
+ 1 67 A n
244
+ 1 68 U n
245
+ 1 69 U n
246
+ 1 70 C n
247
+ 1 71 G n
248
+ 1 72 C n
249
+ 1 73 A n
250
+ 1 74 C n
251
+ 1 75 C n
252
+ 1 76 A n
253
+ #
254
+ loop_
255
+ _chem_comp.id
256
+ _chem_comp.type
257
+ _chem_comp.mon_nstd_flag
258
+ _chem_comp.name
259
+ _chem_comp.pdbx_synonyms
260
+ _chem_comp.formula
261
+ _chem_comp.formula_weight
262
+ A 'RNA linking' y "ADENOSINE-5'-MONOPHOSPHATE" ? 'C10 H14 N5 O7 P' 347.221
263
+ C 'RNA linking' y "CYTIDINE-5'-MONOPHOSPHATE" ? 'C9 H14 N3 O8 P' 323.197
264
+ G 'RNA linking' y "GUANOSINE-5'-MONOPHOSPHATE" ? 'C10 H14 N5 O8 P' 363.221
265
+ U 'RNA linking' y "URIDINE-5'-MONOPHOSPHATE" ? 'C9 H13 N2 O9 P' 324.181
266
+ #
267
+ loop_
268
+ _pdbx_poly_seq_scheme.asym_id
269
+ _pdbx_poly_seq_scheme.entity_id
270
+ _pdbx_poly_seq_scheme.seq_id
271
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272
+ _pdbx_poly_seq_scheme.ndb_seq_num
273
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274
+ _pdbx_poly_seq_scheme.auth_seq_num
275
+ _pdbx_poly_seq_scheme.pdb_mon_id
276
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277
+ _pdbx_poly_seq_scheme.pdb_strand_id
278
+ _pdbx_poly_seq_scheme.pdb_ins_code
279
+ _pdbx_poly_seq_scheme.hetero
280
+ A 1 1 G 1 1 ? ? ? B . n
281
+ A 1 2 C 2 2 2 C C B . n
282
+ A 1 3 G 3 3 3 G G B . n
283
+ A 1 4 G 4 4 4 G G B . n
284
+ A 1 5 A 5 5 5 A A B . n
285
+ A 1 6 U 6 6 6 U U B . n
286
+ A 1 7 U 7 7 7 U U B . n
287
+ A 1 8 U 8 8 8 U U B . n
288
+ A 1 9 A 9 9 9 A A B . n
289
+ A 1 10 G 10 10 10 G G B . n
290
+ A 1 11 C 11 11 11 C C B . n
291
+ A 1 12 U 12 12 12 U U B . n
292
+ A 1 13 C 13 13 13 C C B . n
293
+ A 1 14 A 14 14 14 A A B . n
294
+ A 1 15 G 15 15 15 G G B . n
295
+ A 1 16 U 16 16 16 U U B . n
296
+ A 1 17 U 17 17 17 U U B . n
297
+ A 1 18 G 18 18 18 G G B . n
298
+ A 1 19 G 19 19 19 G G B . n
299
+ A 1 20 G 20 20 20 G G B . n
300
+ A 1 21 A 21 21 21 A A B . n
301
+ A 1 22 G 22 22 22 G G B . n
302
+ A 1 23 A 23 23 23 A A B . n
303
+ A 1 24 G 24 24 24 G G B . n
304
+ A 1 25 C 25 25 25 C C B . n
305
+ A 1 26 G 26 26 26 G G B . n
306
+ A 1 27 C 27 27 27 C C B . n
307
+ A 1 28 C 28 28 28 C C B . n
308
+ A 1 29 A 29 29 29 A A B . n
309
+ A 1 30 G 30 30 30 G G B . n
310
+ A 1 31 A 31 31 31 A A B . n
311
+ A 1 32 C 32 32 32 C C B . n
312
+ A 1 33 U 33 33 33 U U B . n
313
+ A 1 34 G 34 34 34 G G B . n
314
+ A 1 35 A 35 35 35 A A B . n
315
+ A 1 36 A 36 36 36 A A B . n
316
+ A 1 37 G 37 37 37 G G B . n
317
+ A 1 38 A 38 38 38 A A B . n
318
+ A 1 39 U 39 39 39 U U B . n
319
+ A 1 40 C 40 40 40 C C B . n
320
+ A 1 41 U 41 41 41 U U B . n
321
+ A 1 42 G 42 42 42 G G B . n
322
+ A 1 43 G 43 43 43 G G B . n
323
+ A 1 44 A 44 44 44 A A B . n
324
+ A 1 45 G 45 45 45 G G B . n
325
+ A 1 46 G 46 46 46 G G B . n
326
+ A 1 47 U 47 47 47 U U B . n
327
+ A 1 48 C 48 48 48 C C B . n
328
+ A 1 49 C 49 49 49 C C B . n
329
+ A 1 50 U 50 50 50 U U B . n
330
+ A 1 51 G 51 51 51 G G B . n
331
+ A 1 52 U 52 52 52 U U B . n
332
+ A 1 53 G 53 53 53 G G B . n
333
+ A 1 54 U 54 54 54 U U B . n
334
+ A 1 55 U 55 55 55 U U B . n
335
+ A 1 56 C 56 56 56 C C B . n
336
+ A 1 57 G 57 57 57 G G B . n
337
+ A 1 58 A 58 58 58 A A B . n
338
+ A 1 59 U 59 59 59 U U B . n
339
+ A 1 60 C 60 60 60 C C B . n
340
+ A 1 61 C 61 61 61 C C B . n
341
+ A 1 62 A 62 62 62 A A B . n
342
+ A 1 63 C 63 63 63 C C B . n
343
+ A 1 64 A 64 64 64 A A B . n
344
+ A 1 65 G 65 65 65 G G B . n
345
+ A 1 66 A 66 66 66 A A B . n
346
+ A 1 67 A 67 67 67 A A B . n
347
+ A 1 68 U 68 68 68 U U B . n
348
+ A 1 69 U 69 69 69 U U B . n
349
+ A 1 70 C 70 70 70 C C B . n
350
+ A 1 71 G 71 71 71 G G B . n
351
+ A 1 72 C 72 72 72 C C B . n
352
+ A 1 73 A 73 73 73 A A B . n
353
+ A 1 74 C 74 74 74 C C B . n
354
+ A 1 75 C 75 75 75 C C B . n
355
+ A 1 76 A 76 76 76 A A B . n
356
+ #
357
+ _cell.entry_id 1QZB
358
+ _cell.length_a 1
359
+ _cell.length_b 1
360
+ _cell.length_c 1
361
+ _cell.angle_alpha 90
362
+ _cell.angle_beta 90
363
+ _cell.angle_gamma 90
364
+ _cell.pdbx_unique_axis ?
365
+ _cell.Z_PDB 1
366
+ _cell.length_a_esd ?
367
+ _cell.length_b_esd ?
368
+ _cell.length_c_esd ?
369
+ _cell.angle_alpha_esd ?
370
+ _cell.angle_beta_esd ?
371
+ _cell.angle_gamma_esd ?
372
+ #
373
+ _symmetry.entry_id 1QZB
374
+ _symmetry.space_group_name_H-M 'P 1'
375
+ _symmetry.pdbx_full_space_group_name_H-M ?
376
+ _symmetry.Int_Tables_number 1
377
+ _symmetry.cell_setting ?
378
+ #
379
+ _exptl.entry_id 1QZB
380
+ _exptl.method 'ELECTRON MICROSCOPY'
381
+ _exptl.crystals_number ?
382
+ #
383
+ _refine_hist.pdbx_refine_id 'ELECTRON MICROSCOPY'
384
+ _refine_hist.cycle_id LAST
385
+ _refine_hist.pdbx_number_atoms_protein 0
386
+ _refine_hist.pdbx_number_atoms_nucleic_acid 75
387
+ _refine_hist.pdbx_number_atoms_ligand 0
388
+ _refine_hist.number_atoms_solvent 0
389
+ _refine_hist.number_atoms_total 75
390
+ _refine_hist.d_res_high .
391
+ _refine_hist.d_res_low .
392
+ #
393
+ _database_PDB_matrix.entry_id 1QZB
394
+ _database_PDB_matrix.origx[1][1] 1.000000
395
+ _database_PDB_matrix.origx[1][2] 0.000000
396
+ _database_PDB_matrix.origx[1][3] 0.000000
397
+ _database_PDB_matrix.origx[2][1] 0.000000
398
+ _database_PDB_matrix.origx[2][2] 1.000000
399
+ _database_PDB_matrix.origx[2][3] 0.000000
400
+ _database_PDB_matrix.origx[3][1] 0.000000
401
+ _database_PDB_matrix.origx[3][2] 0.000000
402
+ _database_PDB_matrix.origx[3][3] 1.000000
403
+ _database_PDB_matrix.origx_vector[1] 0.00000
404
+ _database_PDB_matrix.origx_vector[2] 0.00000
405
+ _database_PDB_matrix.origx_vector[3] 0.00000
406
+ #
407
+ _struct.entry_id 1QZB
408
+ _struct.title
409
+ 'Coordinates of the A-site tRNA model fitted into the cryo-EM map of 70S ribosome in the pre-translocational state'
410
+ _struct.pdbx_model_details ?
411
+ _struct.pdbx_CASP_flag ?
412
+ _struct.pdbx_model_type_details ?
413
+ #
414
+ _struct_keywords.entry_id 1QZB
415
+ _struct_keywords.pdbx_keywords RNA
416
+ _struct_keywords.text 'A-site tRNA, RNA'
417
+ #
418
+ _struct_asym.id A
419
+ _struct_asym.pdbx_blank_PDB_chainid_flag N
420
+ _struct_asym.pdbx_modified N
421
+ _struct_asym.entity_id 1
422
+ _struct_asym.details ?
423
+ #
424
+ _struct_ref.id 1
425
+ _struct_ref.entity_id 1
426
+ _struct_ref.db_name PDB
427
+ _struct_ref.db_code 1QZB
428
+ _struct_ref.pdbx_db_accession 1QZB
429
+ _struct_ref.pdbx_db_isoform ?
430
+ _struct_ref.pdbx_seq_one_letter_code ?
431
+ _struct_ref.pdbx_align_begin ?
432
+ #
433
+ _struct_ref_seq.align_id 1
434
+ _struct_ref_seq.ref_id 1
435
+ _struct_ref_seq.pdbx_PDB_id_code 1QZB
436
+ _struct_ref_seq.pdbx_strand_id B
437
+ _struct_ref_seq.seq_align_beg 1
438
+ _struct_ref_seq.pdbx_seq_align_beg_ins_code ?
439
+ _struct_ref_seq.seq_align_end 76
440
+ _struct_ref_seq.pdbx_seq_align_end_ins_code ?
441
+ _struct_ref_seq.pdbx_db_accession 1QZB
442
+ _struct_ref_seq.db_align_beg 1
443
+ _struct_ref_seq.pdbx_db_align_beg_ins_code ?
444
+ _struct_ref_seq.db_align_end 76
445
+ _struct_ref_seq.pdbx_db_align_end_ins_code ?
446
+ _struct_ref_seq.pdbx_auth_seq_align_beg 1
447
+ _struct_ref_seq.pdbx_auth_seq_align_end 76
448
+ #
449
+ _pdbx_struct_assembly.id 1
450
+ _pdbx_struct_assembly.details author_defined_assembly
451
+ _pdbx_struct_assembly.method_details ?
452
+ _pdbx_struct_assembly.oligomeric_details monomeric
453
+ _pdbx_struct_assembly.oligomeric_count 1
454
+ #
455
+ _pdbx_struct_assembly_gen.assembly_id 1
456
+ _pdbx_struct_assembly_gen.oper_expression 1
457
+ _pdbx_struct_assembly_gen.asym_id_list A
458
+ #
459
+ _pdbx_struct_oper_list.id 1
460
+ _pdbx_struct_oper_list.type 'identity operation'
461
+ _pdbx_struct_oper_list.name 1_555
462
+ _pdbx_struct_oper_list.symmetry_operation x,y,z
463
+ _pdbx_struct_oper_list.matrix[1][1] 1.0000000000
464
+ _pdbx_struct_oper_list.matrix[1][2] 0.0000000000
465
+ _pdbx_struct_oper_list.matrix[1][3] 0.0000000000
466
+ _pdbx_struct_oper_list.vector[1] 0.0000000000
467
+ _pdbx_struct_oper_list.matrix[2][1] 0.0000000000
468
+ _pdbx_struct_oper_list.matrix[2][2] 1.0000000000
469
+ _pdbx_struct_oper_list.matrix[2][3] 0.0000000000
470
+ _pdbx_struct_oper_list.vector[2] 0.0000000000
471
+ _pdbx_struct_oper_list.matrix[3][1] 0.0000000000
472
+ _pdbx_struct_oper_list.matrix[3][2] 0.0000000000
473
+ _pdbx_struct_oper_list.matrix[3][3] 1.0000000000
474
+ _pdbx_struct_oper_list.vector[3] 0.0000000000
475
+ #
476
+ _struct_biol.id 1
477
+ _struct_biol.pdbx_parent_biol_id ?
478
+ _struct_biol.details ?
479
+ #
480
+ _pdbx_database_remark.id 999
481
+ _pdbx_database_remark.text
482
+ ;SEQUENCE
483
+ THE STRUCTURE CONTAINS P ATOMS ONLY
484
+ ;
485
+ #
486
+ _em_3d_fitting.id 1
487
+ _em_3d_fitting.entry_id 1QZB
488
+ _em_3d_fitting.ref_protocol OTHER
489
+ _em_3d_fitting.ref_space REAL
490
+ _em_3d_fitting.overall_b_value ?
491
+ _em_3d_fitting.target_criteria ?
492
+ _em_3d_fitting.details 'METHOD--Manual fitting in O'
493
+ _em_3d_fitting.method ?
494
+ #
495
+ _em_3d_fitting_list.3d_fitting_id 1
496
+ _em_3d_fitting_list.id 1
497
+ _em_3d_fitting_list.pdb_entry_id 1OB2
498
+ _em_3d_fitting_list.pdb_chain_id ?
499
+ _em_3d_fitting_list.details ?
500
+ _em_3d_fitting_list.initial_refinement_model_id 1
501
+ _em_3d_fitting_list.chain_id ?
502
+ _em_3d_fitting_list.chain_residue_range ?
503
+ _em_3d_fitting_list.pdb_chain_residue_range ?
504
+ _em_3d_fitting_list.source_name PDB
505
+ _em_3d_fitting_list.type 'experimental model'
506
+ _em_3d_fitting_list.accession_code 1OB2
507
+ #
508
+ _em_3d_reconstruction.entry_id 1QZB
509
+ _em_3d_reconstruction.id 1
510
+ _em_3d_reconstruction.symmetry_type POINT
511
+ _em_3d_reconstruction.num_particles 52181
512
+ _em_3d_reconstruction.image_processing_id 1
513
+ _em_3d_reconstruction.method '3D projection matching; conjugate gradient with regularization'
514
+ _em_3d_reconstruction.nominal_pixel_size ?
515
+ _em_3d_reconstruction.actual_pixel_size 2.82
516
+ _em_3d_reconstruction.resolution 9
517
+ _em_3d_reconstruction.magnification_calibration TMV
518
+ _em_3d_reconstruction.details 'SPIDER package'
519
+ _em_3d_reconstruction.resolution_method ?
520
+ _em_3d_reconstruction.num_class_averages ?
521
+ _em_3d_reconstruction.algorithm ?
522
+ #
523
+ _em_buffer.id 1
524
+ _em_buffer.specimen_id 1
525
+ _em_buffer.name 'Polymix buffer'
526
+ _em_buffer.pH 7.5
527
+ _em_buffer.details 'Polymix buffer'
528
+ #
529
+ loop_
530
+ _em_entity_assembly.id
531
+ _em_entity_assembly.name
532
+ _em_entity_assembly.type
533
+ _em_entity_assembly.parent_id
534
+ _em_entity_assembly.synonym
535
+ _em_entity_assembly.details
536
+ _em_entity_assembly.oligomeric_details
537
+ 1 '70S ribosome' RIBOSOME 0 ?
538
+ ;70S bearing deacylated tRNAfMet in the P site and dipeptidyl MP-tRNA in the A site. Same complex as in project
539
+ 138 but in the absence of Kirromicin. The Phe-tRNA is fully delivered to the A-site and after the peptide bond formation the dipeptidyl-tRNA stays in
540
+ the A site. mRNA codes for MP-stop
541
+ ;
542
+ ?
543
+ 2 tRNA ? 1 ? ? ?
544
+ #
545
+ _em_imaging.entry_id 1QZB
546
+ _em_imaging.id 1
547
+ _em_imaging.specimen_id 1
548
+ _em_imaging.date ?
549
+ _em_imaging.temperature 93
550
+ _em_imaging.microscope_model 'FEI TECNAI F20'
551
+ _em_imaging.nominal_defocus_min 2000
552
+ _em_imaging.nominal_defocus_max 4000
553
+ _em_imaging.tilt_angle_min 0
554
+ _em_imaging.tilt_angle_max 0
555
+ _em_imaging.nominal_cs 2.0
556
+ _em_imaging.mode 'BRIGHT FIELD'
557
+ _em_imaging.illumination_mode 'FLOOD BEAM'
558
+ _em_imaging.nominal_magnification 50000
559
+ _em_imaging.calibrated_magnification 49696
560
+ _em_imaging.electron_source 'FIELD EMISSION GUN'
561
+ _em_imaging.accelerating_voltage 200
562
+ _em_imaging.details ?
563
+ _em_imaging.specimen_holder_type ?
564
+ _em_imaging.specimen_holder_model ?
565
+ _em_imaging.citation_id ?
566
+ _em_imaging.detector_distance ?
567
+ _em_imaging.recording_temperature_maximum ?
568
+ _em_imaging.recording_temperature_minimum ?
569
+ _em_imaging.astigmatism ?
570
+ _em_imaging.electron_beam_tilt_params ?
571
+ #
572
+ _em_sample_support.id 1
573
+ _em_sample_support.specimen_id 1
574
+ _em_sample_support.details 'Quantifoil holley carbon film grids'
575
+ _em_sample_support.film_material ?
576
+ _em_sample_support.grid_material ?
577
+ _em_sample_support.grid_mesh_size ?
578
+ _em_sample_support.grid_type ?
579
+ _em_sample_support.method ?
580
+ #
581
+ _em_vitrification.entry_id 1QZB
582
+ _em_vitrification.id 1
583
+ _em_vitrification.cryogen_name ETHANE
584
+ _em_vitrification.details 'Rapid-freezing in liquid ethane'
585
+ _em_vitrification.citation_id ?
586
+ _em_vitrification.humidity ?
587
+ _em_vitrification.instrument ?
588
+ _em_vitrification.method ?
589
+ _em_vitrification.specimen_id 1
590
+ _em_vitrification.temp ?
591
+ _em_vitrification.time_resolved_state ?
592
+ #
593
+ _em_experiment.entry_id 1QZB
594
+ _em_experiment.id 1
595
+ _em_experiment.aggregation_state PARTICLE
596
+ _em_experiment.entity_assembly_id 1
597
+ _em_experiment.reconstruction_method 'SINGLE PARTICLE'
598
+ #
599
+ _em_single_particle_entity.entry_id 1QZB
600
+ _em_single_particle_entity.id 1
601
+ _em_single_particle_entity.point_symmetry C1
602
+ _em_single_particle_entity.image_processing_id 1
603
+ #
604
+ _pdbx_unobs_or_zero_occ_residues.id 1
605
+ _pdbx_unobs_or_zero_occ_residues.PDB_model_num 1
606
+ _pdbx_unobs_or_zero_occ_residues.polymer_flag Y
607
+ _pdbx_unobs_or_zero_occ_residues.occupancy_flag 1
608
+ _pdbx_unobs_or_zero_occ_residues.auth_asym_id B
609
+ _pdbx_unobs_or_zero_occ_residues.auth_comp_id G
610
+ _pdbx_unobs_or_zero_occ_residues.auth_seq_id 1
611
+ _pdbx_unobs_or_zero_occ_residues.PDB_ins_code ?
612
+ _pdbx_unobs_or_zero_occ_residues.label_asym_id A
613
+ _pdbx_unobs_or_zero_occ_residues.label_comp_id G
614
+ _pdbx_unobs_or_zero_occ_residues.label_seq_id 1
615
+ #
616
+ loop_
617
+ _chem_comp_atom.comp_id
618
+ _chem_comp_atom.atom_id
619
+ _chem_comp_atom.type_symbol
620
+ _chem_comp_atom.pdbx_aromatic_flag
621
+ _chem_comp_atom.pdbx_stereo_config
622
+ _chem_comp_atom.pdbx_ordinal
623
+ A OP3 O N N 1
624
+ A P P N N 2
625
+ A OP1 O N N 3
626
+ A OP2 O N N 4
627
+ A "O5'" O N N 5
628
+ A "C5'" C N N 6
629
+ A "C4'" C N R 7
630
+ A "O4'" O N N 8
631
+ A "C3'" C N S 9
632
+ A "O3'" O N N 10
633
+ A "C2'" C N R 11
634
+ A "O2'" O N N 12
635
+ A "C1'" C N R 13
636
+ A N9 N Y N 14
637
+ A C8 C Y N 15
638
+ A N7 N Y N 16
639
+ A C5 C Y N 17
640
+ A C6 C Y N 18
641
+ A N6 N N N 19
642
+ A N1 N Y N 20
643
+ A C2 C Y N 21
644
+ A N3 N Y N 22
645
+ A C4 C Y N 23
646
+ A HOP3 H N N 24
647
+ A HOP2 H N N 25
648
+ A "H5'" H N N 26
649
+ A "H5''" H N N 27
650
+ A "H4'" H N N 28
651
+ A "H3'" H N N 29
652
+ A "HO3'" H N N 30
653
+ A "H2'" H N N 31
654
+ A "HO2'" H N N 32
655
+ A "H1'" H N N 33
656
+ A H8 H N N 34
657
+ A H61 H N N 35
658
+ A H62 H N N 36
659
+ A H2 H N N 37
660
+ C OP3 O N N 38
661
+ C P P N N 39
662
+ C OP1 O N N 40
663
+ C OP2 O N N 41
664
+ C "O5'" O N N 42
665
+ C "C5'" C N N 43
666
+ C "C4'" C N R 44
667
+ C "O4'" O N N 45
668
+ C "C3'" C N S 46
669
+ C "O3'" O N N 47
670
+ C "C2'" C N R 48
671
+ C "O2'" O N N 49
672
+ C "C1'" C N R 50
673
+ C N1 N N N 51
674
+ C C2 C N N 52
675
+ C O2 O N N 53
676
+ C N3 N N N 54
677
+ C C4 C N N 55
678
+ C N4 N N N 56
679
+ C C5 C N N 57
680
+ C C6 C N N 58
681
+ C HOP3 H N N 59
682
+ C HOP2 H N N 60
683
+ C "H5'" H N N 61
684
+ C "H5''" H N N 62
685
+ C "H4'" H N N 63
686
+ C "H3'" H N N 64
687
+ C "HO3'" H N N 65
688
+ C "H2'" H N N 66
689
+ C "HO2'" H N N 67
690
+ C "H1'" H N N 68
691
+ C H41 H N N 69
692
+ C H42 H N N 70
693
+ C H5 H N N 71
694
+ C H6 H N N 72
695
+ G OP3 O N N 73
696
+ G P P N N 74
697
+ G OP1 O N N 75
698
+ G OP2 O N N 76
699
+ G "O5'" O N N 77
700
+ G "C5'" C N N 78
701
+ G "C4'" C N R 79
702
+ G "O4'" O N N 80
703
+ G "C3'" C N S 81
704
+ G "O3'" O N N 82
705
+ G "C2'" C N R 83
706
+ G "O2'" O N N 84
707
+ G "C1'" C N R 85
708
+ G N9 N Y N 86
709
+ G C8 C Y N 87
710
+ G N7 N Y N 88
711
+ G C5 C Y N 89
712
+ G C6 C N N 90
713
+ G O6 O N N 91
714
+ G N1 N N N 92
715
+ G C2 C N N 93
716
+ G N2 N N N 94
717
+ G N3 N N N 95
718
+ G C4 C Y N 96
719
+ G HOP3 H N N 97
720
+ G HOP2 H N N 98
721
+ G "H5'" H N N 99
722
+ G "H5''" H N N 100
723
+ G "H4'" H N N 101
724
+ G "H3'" H N N 102
725
+ G "HO3'" H N N 103
726
+ G "H2'" H N N 104
727
+ G "HO2'" H N N 105
728
+ G "H1'" H N N 106
729
+ G H8 H N N 107
730
+ G H1 H N N 108
731
+ G H21 H N N 109
732
+ G H22 H N N 110
733
+ U OP3 O N N 111
734
+ U P P N N 112
735
+ U OP1 O N N 113
736
+ U OP2 O N N 114
737
+ U "O5'" O N N 115
738
+ U "C5'" C N N 116
739
+ U "C4'" C N R 117
740
+ U "O4'" O N N 118
741
+ U "C3'" C N S 119
742
+ U "O3'" O N N 120
743
+ U "C2'" C N R 121
744
+ U "O2'" O N N 122
745
+ U "C1'" C N R 123
746
+ U N1 N N N 124
747
+ U C2 C N N 125
748
+ U O2 O N N 126
749
+ U N3 N N N 127
750
+ U C4 C N N 128
751
+ U O4 O N N 129
752
+ U C5 C N N 130
753
+ U C6 C N N 131
754
+ U HOP3 H N N 132
755
+ U HOP2 H N N 133
756
+ U "H5'" H N N 134
757
+ U "H5''" H N N 135
758
+ U "H4'" H N N 136
759
+ U "H3'" H N N 137
760
+ U "HO3'" H N N 138
761
+ U "H2'" H N N 139
762
+ U "HO2'" H N N 140
763
+ U "H1'" H N N 141
764
+ U H3 H N N 142
765
+ U H5 H N N 143
766
+ U H6 H N N 144
767
+ #
768
+ loop_
769
+ _chem_comp_bond.comp_id
770
+ _chem_comp_bond.atom_id_1
771
+ _chem_comp_bond.atom_id_2
772
+ _chem_comp_bond.value_order
773
+ _chem_comp_bond.pdbx_aromatic_flag
774
+ _chem_comp_bond.pdbx_stereo_config
775
+ _chem_comp_bond.pdbx_ordinal
776
+ A OP3 P sing N N 1
777
+ A OP3 HOP3 sing N N 2
778
+ A P OP1 doub N N 3
779
+ A P OP2 sing N N 4
780
+ A P "O5'" sing N N 5
781
+ A OP2 HOP2 sing N N 6
782
+ A "O5'" "C5'" sing N N 7
783
+ A "C5'" "C4'" sing N N 8
784
+ A "C5'" "H5'" sing N N 9
785
+ A "C5'" "H5''" sing N N 10
786
+ A "C4'" "O4'" sing N N 11
787
+ A "C4'" "C3'" sing N N 12
788
+ A "C4'" "H4'" sing N N 13
789
+ A "O4'" "C1'" sing N N 14
790
+ A "C3'" "O3'" sing N N 15
791
+ A "C3'" "C2'" sing N N 16
792
+ A "C3'" "H3'" sing N N 17
793
+ A "O3'" "HO3'" sing N N 18
794
+ A "C2'" "O2'" sing N N 19
795
+ A "C2'" "C1'" sing N N 20
796
+ A "C2'" "H2'" sing N N 21
797
+ A "O2'" "HO2'" sing N N 22
798
+ A "C1'" N9 sing N N 23
799
+ A "C1'" "H1'" sing N N 24
800
+ A N9 C8 sing Y N 25
801
+ A N9 C4 sing Y N 26
802
+ A C8 N7 doub Y N 27
803
+ A C8 H8 sing N N 28
804
+ A N7 C5 sing Y N 29
805
+ A C5 C6 sing Y N 30
806
+ A C5 C4 doub Y N 31
807
+ A C6 N6 sing N N 32
808
+ A C6 N1 doub Y N 33
809
+ A N6 H61 sing N N 34
810
+ A N6 H62 sing N N 35
811
+ A N1 C2 sing Y N 36
812
+ A C2 N3 doub Y N 37
813
+ A C2 H2 sing N N 38
814
+ A N3 C4 sing Y N 39
815
+ C OP3 P sing N N 40
816
+ C OP3 HOP3 sing N N 41
817
+ C P OP1 doub N N 42
818
+ C P OP2 sing N N 43
819
+ C P "O5'" sing N N 44
820
+ C OP2 HOP2 sing N N 45
821
+ C "O5'" "C5'" sing N N 46
822
+ C "C5'" "C4'" sing N N 47
823
+ C "C5'" "H5'" sing N N 48
824
+ C "C5'" "H5''" sing N N 49
825
+ C "C4'" "O4'" sing N N 50
826
+ C "C4'" "C3'" sing N N 51
827
+ C "C4'" "H4'" sing N N 52
828
+ C "O4'" "C1'" sing N N 53
829
+ C "C3'" "O3'" sing N N 54
830
+ C "C3'" "C2'" sing N N 55
831
+ C "C3'" "H3'" sing N N 56
832
+ C "O3'" "HO3'" sing N N 57
833
+ C "C2'" "O2'" sing N N 58
834
+ C "C2'" "C1'" sing N N 59
835
+ C "C2'" "H2'" sing N N 60
836
+ C "O2'" "HO2'" sing N N 61
837
+ C "C1'" N1 sing N N 62
838
+ C "C1'" "H1'" sing N N 63
839
+ C N1 C2 sing N N 64
840
+ C N1 C6 sing N N 65
841
+ C C2 O2 doub N N 66
842
+ C C2 N3 sing N N 67
843
+ C N3 C4 doub N N 68
844
+ C C4 N4 sing N N 69
845
+ C C4 C5 sing N N 70
846
+ C N4 H41 sing N N 71
847
+ C N4 H42 sing N N 72
848
+ C C5 C6 doub N N 73
849
+ C C5 H5 sing N N 74
850
+ C C6 H6 sing N N 75
851
+ G OP3 P sing N N 76
852
+ G OP3 HOP3 sing N N 77
853
+ G P OP1 doub N N 78
854
+ G P OP2 sing N N 79
855
+ G P "O5'" sing N N 80
856
+ G OP2 HOP2 sing N N 81
857
+ G "O5'" "C5'" sing N N 82
858
+ G "C5'" "C4'" sing N N 83
859
+ G "C5'" "H5'" sing N N 84
860
+ G "C5'" "H5''" sing N N 85
861
+ G "C4'" "O4'" sing N N 86
862
+ G "C4'" "C3'" sing N N 87
863
+ G "C4'" "H4'" sing N N 88
864
+ G "O4'" "C1'" sing N N 89
865
+ G "C3'" "O3'" sing N N 90
866
+ G "C3'" "C2'" sing N N 91
867
+ G "C3'" "H3'" sing N N 92
868
+ G "O3'" "HO3'" sing N N 93
869
+ G "C2'" "O2'" sing N N 94
870
+ G "C2'" "C1'" sing N N 95
871
+ G "C2'" "H2'" sing N N 96
872
+ G "O2'" "HO2'" sing N N 97
873
+ G "C1'" N9 sing N N 98
874
+ G "C1'" "H1'" sing N N 99
875
+ G N9 C8 sing Y N 100
876
+ G N9 C4 sing Y N 101
877
+ G C8 N7 doub Y N 102
878
+ G C8 H8 sing N N 103
879
+ G N7 C5 sing Y N 104
880
+ G C5 C6 sing N N 105
881
+ G C5 C4 doub Y N 106
882
+ G C6 O6 doub N N 107
883
+ G C6 N1 sing N N 108
884
+ G N1 C2 sing N N 109
885
+ G N1 H1 sing N N 110
886
+ G C2 N2 sing N N 111
887
+ G C2 N3 doub N N 112
888
+ G N2 H21 sing N N 113
889
+ G N2 H22 sing N N 114
890
+ G N3 C4 sing N N 115
891
+ U OP3 P sing N N 116
892
+ U OP3 HOP3 sing N N 117
893
+ U P OP1 doub N N 118
894
+ U P OP2 sing N N 119
895
+ U P "O5'" sing N N 120
896
+ U OP2 HOP2 sing N N 121
897
+ U "O5'" "C5'" sing N N 122
898
+ U "C5'" "C4'" sing N N 123
899
+ U "C5'" "H5'" sing N N 124
900
+ U "C5'" "H5''" sing N N 125
901
+ U "C4'" "O4'" sing N N 126
902
+ U "C4'" "C3'" sing N N 127
903
+ U "C4'" "H4'" sing N N 128
904
+ U "O4'" "C1'" sing N N 129
905
+ U "C3'" "O3'" sing N N 130
906
+ U "C3'" "C2'" sing N N 131
907
+ U "C3'" "H3'" sing N N 132
908
+ U "O3'" "HO3'" sing N N 133
909
+ U "C2'" "O2'" sing N N 134
910
+ U "C2'" "C1'" sing N N 135
911
+ U "C2'" "H2'" sing N N 136
912
+ U "O2'" "HO2'" sing N N 137
913
+ U "C1'" N1 sing N N 138
914
+ U "C1'" "H1'" sing N N 139
915
+ U N1 C2 sing N N 140
916
+ U N1 C6 sing N N 141
917
+ U C2 O2 doub N N 142
918
+ U C2 N3 sing N N 143
919
+ U N3 C4 sing N N 144
920
+ U N3 H3 sing N N 145
921
+ U C4 O4 doub N N 146
922
+ U C4 C5 sing N N 147
923
+ U C5 C6 doub N N 148
924
+ U C5 H5 sing N N 149
925
+ U C6 H6 sing N N 150
926
+ #
927
+ _em_ctf_correction.id 1
928
+ _em_ctf_correction.details 'CTF correction of 3D maps by Wiener filteration'
929
+ _em_ctf_correction.type .
930
+ #
931
+ _em_image_processing.id 1
932
+ _em_image_processing.image_recording_id 1
933
+ _em_image_processing.details ?
934
+ #
935
+ _em_image_recording.details ?
936
+ _em_image_recording.id 1
937
+ _em_image_recording.avg_electron_dose_per_image 20
938
+ _em_image_recording.film_or_detector_model 'KODAK SO-163 FILM'
939
+ _em_image_recording.imaging_id 1
940
+ _em_image_recording.detector_mode ?
941
+ _em_image_recording.average_exposure_time ?
942
+ _em_image_recording.num_diffraction_images ?
943
+ _em_image_recording.num_grids_imaged ?
944
+ _em_image_recording.num_real_images ?
945
+ #
946
+ _em_specimen.experiment_id 1
947
+ _em_specimen.id 1
948
+ _em_specimen.concentration 32
949
+ _em_specimen.vitrification_applied YES
950
+ _em_specimen.staining_applied NO
951
+ _em_specimen.embedding_applied NO
952
+ _em_specimen.shadowing_applied NO
953
+ _em_specimen.details ?
954
+ #
955
+ _pdbx_coordinate_model.asym_id A
956
+ _pdbx_coordinate_model.type 'P ATOMS ONLY'
957
+ #
958
+ _pdbx_initial_refinement_model.id 1
959
+ _pdbx_initial_refinement_model.type 'experimental model'
960
+ _pdbx_initial_refinement_model.source_name PDB
961
+ _pdbx_initial_refinement_model.accession_code 1OB2
962
+ #
963
+ _atom_sites.entry_id 1QZB
964
+ _atom_sites.fract_transf_matrix[1][1] 1.000000
965
+ _atom_sites.fract_transf_matrix[1][2] 0.000000
966
+ _atom_sites.fract_transf_matrix[1][3] 0.000000
967
+ _atom_sites.fract_transf_matrix[2][1] 0.000000
968
+ _atom_sites.fract_transf_matrix[2][2] 1.000000
969
+ _atom_sites.fract_transf_matrix[2][3] 0.000000
970
+ _atom_sites.fract_transf_matrix[3][1] 0.000000
971
+ _atom_sites.fract_transf_matrix[3][2] 0.000000
972
+ _atom_sites.fract_transf_matrix[3][3] 1.000000
973
+ _atom_sites.fract_transf_vector[1] 0.00000
974
+ _atom_sites.fract_transf_vector[2] 0.00000
975
+ _atom_sites.fract_transf_vector[3] 0.00000
976
+ #
977
+ _atom_type.symbol P
978
+ #
979
+ loop_
980
+ _atom_site.group_PDB
981
+ _atom_site.id
982
+ _atom_site.type_symbol
983
+ _atom_site.label_atom_id
984
+ _atom_site.label_alt_id
985
+ _atom_site.label_comp_id
986
+ _atom_site.label_asym_id
987
+ _atom_site.label_entity_id
988
+ _atom_site.label_seq_id
989
+ _atom_site.pdbx_PDB_ins_code
990
+ _atom_site.Cartn_x
991
+ _atom_site.Cartn_y
992
+ _atom_site.Cartn_z
993
+ _atom_site.occupancy
994
+ _atom_site.B_iso_or_equiv
995
+ _atom_site.pdbx_formal_charge
996
+ _atom_site.auth_seq_id
997
+ _atom_site.auth_comp_id
998
+ _atom_site.auth_asym_id
999
+ _atom_site.auth_atom_id
1000
+ _atom_site.pdbx_PDB_model_num
1001
+ ATOM 1 P P . C A 1 2 ? -5.758 0.226 -37.611 1.00 36.15 ? 2 C B P 1
1002
+ ATOM 2 P P . G A 1 3 ? -7.548 -4.817 -35.780 1.00 38.57 ? 3 G B P 1
1003
+ ATOM 3 P P . G A 1 4 ? -11.932 -7.551 -32.336 1.00 50.13 ? 4 G B P 1
1004
+ ATOM 4 P P . A A 1 5 ? -16.795 -7.912 -28.958 1.00 46.12 ? 5 A B P 1
1005
+ ATOM 5 P P . U A 1 6 ? -21.805 -6.611 -26.755 1.00 41.93 ? 6 U B P 1
1006
+ ATOM 6 P P . U A 1 7 ? -26.975 -3.593 -26.744 1.00 39.61 ? 7 U B P 1
1007
+ ATOM 7 P P . U A 1 8 ? -31.089 2.030 -27.580 1.00 38.44 ? 8 U B P 1
1008
+ ATOM 8 P P . A A 1 9 ? -35.423 2.775 -28.335 1.00 30.30 ? 9 A B P 1
1009
+ ATOM 9 P P . G A 1 10 ? -39.050 8.345 -28.654 1.00 36.63 ? 10 G B P 1
1010
+ ATOM 10 P P . C A 1 11 ? -34.755 8.904 -24.262 1.00 48.28 ? 11 C B P 1
1011
+ ATOM 11 P P . U A 1 12 ? -32.369 6.465 -19.720 1.00 38.23 ? 12 U B P 1
1012
+ ATOM 12 P P . C A 1 13 ? -31.272 1.173 -17.685 1.00 37.44 ? 13 C B P 1
1013
+ ATOM 13 P P . A A 1 14 ? -31.981 -5.471 -20.177 1.00 33.32 ? 14 A B P 1
1014
+ ATOM 14 P P . G A 1 15 ? -33.645 -10.686 -23.328 1.00 33.55 ? 15 G B P 1
1015
+ ATOM 15 P P . U A 1 16 ? -34.340 -13.695 -27.700 1.00 58.67 ? 16 U B P 1
1016
+ ATOM 16 P P . U A 1 17 ? -33.883 -16.686 -32.752 1.00 63.01 ? 17 U B P 1
1017
+ ATOM 17 P P . G A 1 18 ? -31.259 -15.909 -38.418 1.00 51.43 ? 18 G B P 1
1018
+ ATOM 18 P P . G A 1 19 ? -37.225 -13.180 -38.500 1.00 56.66 ? 19 G B P 1
1019
+ ATOM 19 P P . G A 1 20 ? -43.864 -11.829 -38.957 1.00 82.09 ? 20 G B P 1
1020
+ ATOM 20 P P . A A 1 21 ? -43.635 -6.120 -36.923 1.00 46.40 ? 21 A B P 1
1021
+ ATOM 21 P P . G A 1 22 ? -46.276 -4.974 -30.765 1.00 19.04 ? 22 G B P 1
1022
+ ATOM 22 P P . A A 1 23 ? -47.138 -2.794 -24.117 1.00 28.32 ? 23 A B P 1
1023
+ ATOM 23 P P . G A 1 24 ? -48.093 -1.758 -18.840 1.00 33.68 ? 24 G B P 1
1024
+ ATOM 24 P P . C A 1 25 ? -47.497 2.456 -15.297 1.00 50.66 ? 25 C B P 1
1025
+ ATOM 25 P P . G A 1 26 ? -46.529 8.123 -14.354 1.00 60.43 ? 26 G B P 1
1026
+ ATOM 26 P P . C A 1 27 ? -46.631 13.381 -17.559 1.00 88.39 ? 27 C B P 1
1027
+ ATOM 27 P P . C A 1 28 ? -50.041 15.583 -21.816 1.00 108.26 ? 28 C B P 1
1028
+ ATOM 28 P P . A A 1 29 ? -55.442 16.471 -23.178 1.00 132.50 ? 29 A B P 1
1029
+ ATOM 29 P P . G A 1 30 ? -61.462 15.138 -21.832 1.00 164.78 ? 30 G B P 1
1030
+ ATOM 30 P P . A A 1 31 ? -66.694 12.686 -19.173 1.00 172.07 ? 31 A B P 1
1031
+ ATOM 31 P P . C A 1 32 ? -67.465 12.084 -14.147 1.00 176.80 ? 32 C B P 1
1032
+ ATOM 32 P P . U A 1 33 ? -68.159 13.437 -8.953 1.00 200.00 ? 33 U B P 1
1033
+ ATOM 33 P P . G A 1 34 ? -67.519 18.178 -6.035 1.00 193.77 ? 34 G B P 1
1034
+ ATOM 34 P P . A A 1 35 ? -64.029 19.550 -9.947 1.00 185.75 ? 35 A B P 1
1035
+ ATOM 35 P P . A A 1 36 ? -57.782 18.089 -10.796 1.00 196.33 ? 36 A B P 1
1036
+ ATOM 36 P P . G A 1 37 ? -52.701 16.655 -10.766 1.00 200.00 ? 37 G B P 1
1037
+ ATOM 37 P P . A A 1 38 ? -50.476 11.124 -9.444 1.00 193.90 ? 38 A B P 1
1038
+ ATOM 38 P P . U A 1 39 ? -50.948 5.622 -8.416 1.00 171.33 ? 39 U B P 1
1039
+ ATOM 39 P P . C A 1 40 ? -54.795 1.745 -11.425 1.00 160.10 ? 40 C B P 1
1040
+ ATOM 40 P P . U A 1 41 ? -58.057 -0.588 -15.208 1.00 138.03 ? 41 U B P 1
1041
+ ATOM 41 P P . G A 1 42 ? -59.186 -0.594 -20.774 1.00 119.52 ? 42 G B P 1
1042
+ ATOM 42 P P . G A 1 43 ? -57.754 1.195 -26.794 1.00 93.55 ? 43 G B P 1
1043
+ ATOM 43 P P . A A 1 44 ? -53.639 3.584 -31.333 1.00 91.74 ? 44 A B P 1
1044
+ ATOM 44 P P . G A 1 45 ? -49.295 5.893 -33.760 1.00 78.71 ? 45 G B P 1
1045
+ ATOM 45 P P . G A 1 46 ? -43.788 6.888 -33.961 1.00 60.98 ? 46 G B P 1
1046
+ ATOM 46 P P . U A 1 47 ? -37.838 6.244 -35.147 1.00 78.20 ? 47 U B P 1
1047
+ ATOM 47 P P . C A 1 48 ? -35.552 0.173 -37.919 1.00 52.65 ? 48 C B P 1
1048
+ ATOM 48 P P . C A 1 49 ? -30.710 -0.642 -33.151 1.00 17.11 ? 49 C B P 1
1049
+ ATOM 49 P P . U A 1 50 ? -31.003 2.711 -37.547 1.00 17.58 ? 50 U B P 1
1050
+ ATOM 50 P P . G A 1 51 ? -30.216 3.602 -43.159 1.00 21.85 ? 51 G B P 1
1051
+ ATOM 51 P P . U A 1 52 ? -28.755 2.168 -48.651 1.00 7.73 ? 52 U B P 1
1052
+ ATOM 52 P P . G A 1 53 ? -27.240 -2.779 -52.407 1.00 11.78 ? 53 G B P 1
1053
+ ATOM 53 P P . U A 1 54 ? -26.502 -8.282 -54.350 1.00 17.41 ? 54 U B P 1
1054
+ ATOM 54 P P . U A 1 55 ? -28.779 -13.145 -54.296 1.00 30.57 ? 55 U B P 1
1055
+ ATOM 55 P P . C A 1 56 ? -33.926 -14.897 -54.061 1.00 40.60 ? 56 C B P 1
1056
+ ATOM 56 P P . G A 1 57 ? -35.724 -10.053 -52.490 1.00 37.48 ? 57 G B P 1
1057
+ ATOM 57 P P . A A 1 58 ? -35.429 -6.974 -47.533 1.00 32.55 ? 58 A B P 1
1058
+ ATOM 58 P P . U A 1 59 ? -34.995 -4.688 -41.776 1.00 48.23 ? 59 U B P 1
1059
+ ATOM 59 P P . C A 1 60 ? -30.358 -6.402 -39.602 1.00 26.95 ? 60 C B P 1
1060
+ ATOM 60 P P . C A 1 61 ? -25.991 -10.032 -36.513 1.00 28.80 ? 61 C B P 1
1061
+ ATOM 61 P P . A A 1 62 ? -21.743 -11.751 -39.587 1.00 25.23 ? 62 A B P 1
1062
+ ATOM 62 P P . C A 1 63 ? -17.611 -9.879 -42.987 1.00 28.44 ? 63 C B P 1
1063
+ ATOM 63 P P . A A 1 64 ? -14.912 -4.910 -45.463 1.00 30.74 ? 64 A B P 1
1064
+ ATOM 64 P P . G A 1 65 ? -14.792 1.623 -43.525 1.00 13.07 ? 65 G B P 1
1065
+ ATOM 65 P P . A A 1 66 ? -16.376 5.987 -38.708 1.00 22.92 ? 66 A B P 1
1066
+ ATOM 66 P P . A A 1 67 ? -18.028 9.316 -34.410 1.00 22.81 ? 67 A B P 1
1067
+ ATOM 67 P P . U A 1 68 ? -18.743 10.679 -28.875 1.00 45.82 ? 68 U B P 1
1068
+ ATOM 68 P P . U A 1 69 ? -17.308 8.873 -23.402 1.00 51.04 ? 69 U B P 1
1069
+ ATOM 69 P P . C A 1 70 ? -13.801 4.791 -20.033 1.00 50.83 ? 70 C B P 1
1070
+ ATOM 70 P P . G A 1 71 ? -9.372 1.245 -18.842 1.00 54.67 ? 71 G B P 1
1071
+ ATOM 71 P P . C A 1 72 ? -3.810 -1.314 -20.206 1.00 59.46 ? 72 C B P 1
1072
+ ATOM 72 P P . A A 1 73 ? 0.567 -1.911 -22.800 1.00 59.61 ? 73 A B P 1
1073
+ ATOM 73 P P . C A 1 74 ? 4.732 -2.057 -20.714 1.00 59.61 ? 74 C B P 1
1074
+ ATOM 74 P P . C A 1 75 ? 9.331 -7.269 -18.282 1.00 55.58 ? 75 C B P 1
1075
+ ATOM 75 P P . A A 1 76 ? 14.175 -6.671 -16.870 1.00 59.61 ? 76 A B P 1
1076
+ #
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