eF-site ID 6h1o-B
PDB Code 6h1o
Chain B

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Title Structure of the BM3 heme domain in complex with voriconazole
Classification OXIDOREDUCTASE
Compound Bifunctional cytochrome P450/NADPH--P450 reductase
Source (CPXB_BACMB)
Sequence B:  TIKEMPQPKTFGELKNLPLLNTDKPVQALMKIADELGEIF
KFEAPGRVTRYLSSQRLIKEACDESRFDKNLSQALKFVRD
FFGDGLVTSWTHEKNWKKAHNILLPSFSQQAMKGYHAMMV
DIAVQLVQKWERLNADEHIEVPEDMTRLTLDTIGLCGFNY
RFNSFYRDQPHPFITSMVRALDEAMNKLQRANPDDPAYDE
NKRQFQEDIKVMNDLVDKIIADRKASGEQSDDLLTHMLNG
KDPETGEPLDDENIRYQIITFLIAGHETTSGLLSFALYFL
VKNPHVLQKAAEEAARVLVDPVPSYKQVKQLKYVGMVLNE
ALRLWPTAPAFSLYAKEDTVLGGEYPLEKGDELMVLIPQL
HRDKTIWGDDVEEFRPERFENPSAIPQHAFKPFGNGQRAC
IGQQFALHEATLVLGMMLKHFDFEDHTNYELDIKETLTLK
PEGFVVKAKSKKIPLGG
Description


Functional site

1) chain B
residue 366
type
sequence I
description binding site for residue GOL A 506
source : AC6

2) chain B
residue 378
type
sequence R
description binding site for residue GOL A 506
source : AC6

3) chain B
residue 384
type
sequence A
description binding site for residue GOL A 506
source : AC6

4) chain B
residue 385
type
sequence I
description binding site for residue GOL A 506
source : AC6

5) chain B
residue 386
type
sequence P
description binding site for residue GOL A 506
source : AC6

6) chain B
residue 69
type
sequence K
description binding site for residue HEM B 501
source : AD1

7) chain B
residue 75
type
sequence L
description binding site for residue HEM B 501
source : AD1

8) chain B
residue 86
type
sequence L
description binding site for residue HEM B 501
source : AD1

9) chain B
residue 87
type
sequence V
description binding site for residue HEM B 501
source : AD1

10) chain B
residue 96
type
sequence W
description binding site for residue HEM B 501
source : AD1

11) chain B
residue 261
type
sequence F
description binding site for residue HEM B 501
source : AD1

12) chain B
residue 264
type
sequence A
description binding site for residue HEM B 501
source : AD1

13) chain B
residue 265
type
sequence G
description binding site for residue HEM B 501
source : AD1

14) chain B
residue 268
type
sequence T
description binding site for residue HEM B 501
source : AD1

15) chain B
residue 269
type
sequence T
description binding site for residue HEM B 501
source : AD1

16) chain B
residue 327
type
sequence T
description binding site for residue HEM B 501
source : AD1

17) chain B
residue 331
type
sequence F
description binding site for residue HEM B 501
source : AD1

18) chain B
residue 392
type
sequence P
description binding site for residue HEM B 501
source : AD1

19) chain B
residue 393
type
sequence F
description binding site for residue HEM B 501
source : AD1

20) chain B
residue 394
type
sequence G
description binding site for residue HEM B 501
source : AD1

21) chain B
residue 398
type
sequence R
description binding site for residue HEM B 501
source : AD1

22) chain B
residue 399
type
sequence A
description binding site for residue HEM B 501
source : AD1

23) chain B
residue 400
type
sequence C
description binding site for residue HEM B 501
source : AD1

24) chain B
residue 401
type
sequence I
description binding site for residue HEM B 501
source : AD1

25) chain B
residue 402
type
sequence G
description binding site for residue HEM B 501
source : AD1

26) chain B
residue 75
type
sequence L
description binding site for residue VOR B 502
source : AD2

27) chain B
residue 82
type
sequence F
description binding site for residue VOR B 502
source : AD2

28) chain B
residue 87
type
sequence V
description binding site for residue VOR B 502
source : AD2

29) chain B
residue 181
type
sequence L
description binding site for residue VOR B 502
source : AD2

30) chain B
residue 263
type
sequence I
description binding site for residue VOR B 502
source : AD2

31) chain B
residue 264
type
sequence A
description binding site for residue VOR B 502
source : AD2

32) chain B
residue 267
type
sequence E
description binding site for residue VOR B 502
source : AD2

33) chain B
residue 268
type
sequence T
description binding site for residue VOR B 502
source : AD2

34) chain B
residue 437
type
sequence L
description binding site for residue VOR B 502
source : AD2

35) chain B
residue 80
type
sequence D
description binding site for residue PO4 B 503
source : AD3

36) chain B
residue 81
type
sequence F
description binding site for residue PO4 B 503
source : AD3

37) chain B
residue 205
type
sequence F
description binding site for residue PO4 B 503
source : AD3

38) chain B
residue 209
type
sequence I
description binding site for residue PO4 B 503
source : AD3

39) chain B
residue 247
type
sequence E
description binding site for residue PO4 B 504
source : AD4

40) chain B
residue 427
type
sequence T
description binding site for residue PO4 B 504
source : AD4

41) chain B
residue 428
type
sequence N
description binding site for residue PO4 B 504
source : AD4

42) chain B
residue 281
type
sequence V
description binding site for residue GOL B 505
source : AD5

43) chain B
residue 425
type
sequence D
description binding site for residue GOL B 505
source : AD5

44) chain B
residue 428
type
sequence N
description binding site for residue GOL B 505
source : AD5

45) chain B
residue 51
type BINDING
sequence Y
description BINDING => ECO:0000269|PubMed:15020590, ECO:0007744|PDB:1SMJ
source Swiss-Prot : SWS_FT_FI1

46) chain B
residue 268
type catalytic
sequence T
description 699
source MCSA : MCSA2

47) chain B
residue 393
type catalytic
sequence F
description 699
source MCSA : MCSA2

48) chain B
residue 400
type catalytic
sequence C
description 699
source MCSA : MCSA2

49) chain B
residue 268
type SITE
sequence T
description Important for catalytic activity => ECO:0000305|PubMed:16403573, ECO:0000305|PubMed:7578081
source Swiss-Prot : SWS_FT_FI3

50) chain B
residue 400
type BINDING
sequence C
description axial binding residue => ECO:0000269|PubMed:10051560, ECO:0000269|PubMed:11695889, ECO:0000269|PubMed:11695892, ECO:0000269|PubMed:14653735, ECO:0000269|PubMed:15020590, ECO:0000269|PubMed:15299332, ECO:0000269|PubMed:16403573, ECO:0000269|PubMed:17077084, ECO:0000269|PubMed:17429965, ECO:0000269|PubMed:17868686, ECO:0000269|PubMed:18004886, ECO:0000269|PubMed:18298086, ECO:0000269|PubMed:18619466, ECO:0000269|PubMed:18721129, ECO:0000269|PubMed:19492389, ECO:0000269|PubMed:20180779, ECO:0000269|PubMed:20947800, ECO:0000269|PubMed:21110374, ECO:0000269|PubMed:21875028, ECO:0000269|PubMed:7578081, ECO:0000269|PubMed:8342039, ECO:0000269|PubMed:9033595, ECO:0007744|PDB:1BU7, ECO:0007744|PDB:1BVY, ECO:0007744|PDB:1FAG, ECO:0007744|PDB:1FAH, ECO:0007744|PDB:1JME, ECO:0007744|PDB:1JPZ, ECO:0007744|PDB:1P0V, ECO:0007744|PDB:1P0W, ECO:0007744|PDB:1P0X, ECO:0007744|PDB:1SMI, ECO:0007744|PDB:1SMJ, ECO:0007744|PDB:1YQO, ECO:0007744|PDB:1YQP, ECO:0007744|PDB:1ZO4, ECO:0007744|PDB:1ZO9, ECO:0007744|PDB:1ZOA, ECO:0007744|PDB:2BMH, ECO:0007744|PDB:2HPD, ECO:0007744|PDB:2IJ2, ECO:0007744|PDB:2IJ3, ECO:0007744|PDB:2IJ4, ECO:0007744|PDB:2J1M, ECO:0007744|PDB:2J4S, ECO:0007744|PDB:2UWH, ECO:0007744|PDB:3BEN, ECO:0007744|PDB:3CBD, ECO:0007744|PDB:3EKB, ECO:0007744|PDB:3EKD, ECO:0007744|PDB:3EKF, ECO:0007744|PDB:3HF2, ECO:0007744|PDB:3KX3, ECO:0007744|PDB:3KX4, ECO:0007744|PDB:3KX5, ECO:0007744|PDB:3M4V, ECO:0007744|PDB:3NPL
source Swiss-Prot : SWS_FT_FI2


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