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6DUH

Crystal structure of HIV-1 reverse transcriptase Y181I mutant in complex with non-nucleoside inhibitor 25a

Functional Information from GO Data
ChainGOidnamespacecontents
A0003676molecular_functionnucleic acid binding
A0003964molecular_functionRNA-directed DNA polymerase activity
A0004523molecular_functionRNA-DNA hybrid ribonuclease activity
A0006278biological_processRNA-templated DNA biosynthetic process
B0003964molecular_functionRNA-directed DNA polymerase activity
B0006278biological_processRNA-templated DNA biosynthetic process
Functional Information from PDB Data
site_idAC1
Number of Residues19
Detailsbinding site for residue K5C A 601
ChainResidue
ALEU100
APHE227
ATRP229
AHIS235
APRO236
ATYR318
AHOH758
AHOH865
BPRO95
BGLU138
BHOH740
ALYS101
ALYS103
ALYS104
ASER105
AVAL106
AVAL179
AILE181
ATYR188

site_idAC2
Number of Residues6
Detailsbinding site for residue MG A 602
ChainResidue
AASP443
AASP549
AHOH747
AHOH828
AHOH910
AHOH927

site_idAC3
Number of Residues4
Detailsbinding site for residue SO4 A 603
ChainResidue
ALYS73
ATYR146
APRO150
AGLN151

site_idAC4
Number of Residues3
Detailsbinding site for residue SO4 A 604
ChainResidue
ALYS331
AGLY333
AGLN334

site_idAC5
Number of Residues4
Detailsbinding site for residue SO4 A 605
ChainResidue
ALYS476
ASER515
AGLU516
ALEU517

site_idAC6
Number of Residues5
Detailsbinding site for residue SO4 A 606
ChainResidue
ATYR427
AGLN428
ALEU525
ALYS528
AGLU529

site_idAC7
Number of Residues6
Detailsbinding site for residue SO4 A 607
ChainResidue
AGLU138
AGLN500
ATRP535
AHOH757
BGLN269
BTRP426

site_idAC8
Number of Residues4
Detailsbinding site for residue EDO A 608
ChainResidue
AGLU6
ALYS166
AHOH842
BILE50

site_idAC9
Number of Residues4
Detailsbinding site for residue EDO A 609
ChainResidue
ALYS166
APRO170
ATRP212
AHOH739

site_idAD1
Number of Residues3
Detailsbinding site for residue EDO A 610
ChainResidue
AASP488
ASER489
AGLY490

site_idAD2
Number of Residues4
Detailsbinding site for residue EDO A 611
ChainResidue
AARG448
ATHR473
AASN474
AGLN475

site_idAD3
Number of Residues6
Detailsbinding site for residue EDO A 612
ChainResidue
ASER268
ATYR339
AGLY352
ALYS353
ALYS374
AHOH974

site_idAD4
Number of Residues5
Detailsbinding site for residue EDO A 613
ChainResidue
ALEU425
ATRP426
ATYR427
AGLN509
AHOH834

site_idAD5
Number of Residues4
Detailsbinding site for residue EDO A 614
ChainResidue
ALEU491
AGLN524
ALYS527
ALYS528

site_idAD6
Number of Residues5
Detailsbinding site for residue EDO A 615
ChainResidue
ATRP88
AHOH860
BLYS20
BVAL21
BHOH655

site_idAD7
Number of Residues8
Detailsbinding site for residue EDO A 616
ChainResidue
AGLU404
ATYR405
ATRP406
AGLN507
AGLN509
AHOH861
BLYS424
BSO4503

site_idAD8
Number of Residues4
Detailsbinding site for residue EDO A 617
ChainResidue
AGLU6
AVAL8
ASER163
AHOH818

site_idAD9
Number of Residues5
Detailsbinding site for residue EDO A 618
ChainResidue
ATRP426
AASP511
ALYS512
AILE526
AHOH929

site_idAE1
Number of Residues4
Detailsbinding site for residue EDO A 619
ChainResidue
AGLY231
AVAL241
AGLN242
ATRP266

site_idAE2
Number of Residues7
Detailsbinding site for residue EDO A 620
ChainResidue
ATHR165
ALEU168
AILE180
AHOH754
AHOH774
AHOH917
AHOH948

site_idAE3
Number of Residues4
Detailsbinding site for residue EDO A 621
ChainResidue
ATHR7
AASP121
AGLU122
AASP123

site_idAE4
Number of Residues7
Detailsbinding site for residue DMS B 501
ChainResidue
AILE380
BTHR27
BTHR400
BTRP401
BTHR403
BGLU404
BEDO513

site_idAE5
Number of Residues5
Detailsbinding site for residue SO4 B 502
ChainResidue
AHOH957
BTYR56
BLYS126
BHOH674
BHOH760

site_idAE6
Number of Residues7
Detailsbinding site for residue SO4 B 503
ChainResidue
ATHR403
AGLU404
AEDO616
BLYS331
BGLN332
BGLY333
BLYS424

site_idAE7
Number of Residues4
Detailsbinding site for residue SO4 B 504
ChainResidue
BLYS275
BVAL276
BARG277
BHOH751

site_idAE8
Number of Residues6
Detailsbinding site for residue EDO B 505
ChainResidue
BGLU328
BILE329
BGLN330
BPRO392
BPRO421
BHOH770

site_idAE9
Number of Residues5
Detailsbinding site for residue EDO B 506
ChainResidue
BVAL75
BPHE77
BASN81
BGLY152
BILE411

site_idAF1
Number of Residues4
Detailsbinding site for residue EDO B 507
ChainResidue
BTYR183
BLYS385
BTHR386
BHOH622

site_idAF2
Number of Residues3
Detailsbinding site for residue EDO B 508
ChainResidue
BGLU399
BTRP402
BHOH723

site_idAF3
Number of Residues4
Detailsbinding site for residue EDO B 509
ChainResidue
BGLN242
BTYR339
BGLY352
BLYS353

site_idAF4
Number of Residues6
Detailsbinding site for residue EDO B 510
ChainResidue
BLYS66
BGLU370
BGLN373
BLYS374
BGLN407
BHOH643

site_idAF5
Number of Residues2
Detailsbinding site for residue EDO B 511
ChainResidue
BLYS395
BHOH640

site_idAF6
Number of Residues2
Detailsbinding site for residue EDO B 512
ChainResidue
BHIS235
BTRP239

site_idAF7
Number of Residues5
Detailsbinding site for residue EDO B 513
ChainResidue
ATHR377
BTRP24
BPRO25
BTHR400
BDMS501

site_idAF8
Number of Residues8
Detailsbinding site for residue EDO B 514
ChainResidue
AHOH769
BGLN340
BTYR342
BPRO345
BPHE346
BASN348
BHOH660
BHOH720

site_idAF9
Number of Residues2
Detailsbinding site for residue EDO B 515
ChainResidue
BGLU42
BLYS43

site_idAG1
Number of Residues6
Detailsbinding site for residue EDO B 516
ChainResidue
AGLU432
APRO433
BTHR253
BASN255
BASP256
BLYS259

site_idAG2
Number of Residues5
Detailsbinding site for residue EDO B 517
ChainResidue
BLYS20
BVAL21
BLYS22
BHOH618
BHOH696

site_idAG3
Number of Residues4
Detailsbinding site for residue EDO B 518
ChainResidue
ATRP402
ATHR403
BGLY333
BGLN334

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues3
DetailsBINDING:
ChainResidueDetails
BASP110
BASP185
BASP186

site_idSWS_FT_FI2
Number of Residues2
DetailsSITE: Essential for RT p66/p51 heterodimerization
ChainResidueDetails
BTRP401
BTRP414
AASP498
AASP549

site_idSWS_FT_FI3
Number of Residues2
DetailsSITE: Essential for RT p66/p51 heterodimerization
ChainResidueDetails
ATRP401
ATRP414

site_idSWS_FT_FI4
Number of Residues1
DetailsSITE: Cleavage; by viral protease; partial
ChainResidueDetails
APHE440

224931

PDB entries from 2024-09-11

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