eF-site ID 4d33-A
PDB Code 4d33
Chain A

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Title Structure of bovine endothelial nitric oxide synthase heme domain in complex with (N1-(2-(1H-imidazol-1-yl)pyrimidin-4-yl)-N2-(3- fluorophenethyl)ethane-1,2-diamine
Classification OXIDOREDUCTASE
Compound NITRIC OXIDE SYNTHASE, ENDOTHELIAL
Source Bos taurus (Bovine) (NOS3_BOVIN)
Sequence A:  GPKFPRVKNWELGSITYDTLCAQSQQDGPCTPRRCLGSLV
LPRPAEQLLSQARDFINQYYSSIKRSGSQAHEERLQEVEA
EVASTGTYHLRESELVFGAKQAWRNAPRCVGRIQWGKLQV
FDARDCSSAQEMFTYICNHIKYATNRGNLRSAITVFPQRA
PGRGDFRIWNSQLVRYAGYRQQDGSVRGDPANVEITELCI
QHGWTPGNGRFDVLPLLLQAPDEAPELFVLPPELVLEVPL
EHPTLEWFAALGLRWYALPAVSNMLLEIGGLEFSAAPFSG
WYMSTEIGTRNLCDPHRYNILEDVAVCMDLDTRTTSSLWK
DKAAVEINLAVLHSFQLAKVTIVDHHAATVSFMKHLDNEQ
KARGGCPADWAWIVPPISGSLTPVFHQEMVNYILSPAFRY
QPDPW
Description (1)  NITRIC OXIDE SYNTHASE, ENDOTHELIAL (E.C.1.14.13.39)


Functional site

1) chain A
residue 180
type
sequence W
description BINDING SITE FOR RESIDUE HEM A 500
source : AC1

2) chain A
residue 185
type
sequence R
description BINDING SITE FOR RESIDUE HEM A 500
source : AC1

3) chain A
residue 186
type
sequence C
description BINDING SITE FOR RESIDUE HEM A 500
source : AC1

4) chain A
residue 187
type
sequence V
description BINDING SITE FOR RESIDUE HEM A 500
source : AC1

5) chain A
residue 188
type
sequence G
description BINDING SITE FOR RESIDUE HEM A 500
source : AC1

6) chain A
residue 228
type
sequence S
description BINDING SITE FOR RESIDUE HEM A 500
source : AC1

7) chain A
residue 355
type
sequence F
description BINDING SITE FOR RESIDUE HEM A 500
source : AC1

8) chain A
residue 356
type
sequence S
description BINDING SITE FOR RESIDUE HEM A 500
source : AC1

9) chain A
residue 357
type
sequence G
description BINDING SITE FOR RESIDUE HEM A 500
source : AC1

10) chain A
residue 358
type
sequence W
description BINDING SITE FOR RESIDUE HEM A 500
source : AC1

11) chain A
residue 360
type
sequence M
description BINDING SITE FOR RESIDUE HEM A 500
source : AC1

12) chain A
residue 363
type
sequence E
description BINDING SITE FOR RESIDUE HEM A 500
source : AC1

13) chain A
residue 449
type
sequence W
description BINDING SITE FOR RESIDUE HEM A 500
source : AC1

14) chain A
residue 475
type
sequence F
description BINDING SITE FOR RESIDUE HEM A 500
source : AC1

15) chain A
residue 477
type
sequence Y
description BINDING SITE FOR RESIDUE HEM A 500
source : AC1

16) chain A
residue 104
type
sequence S
description BINDING SITE FOR RESIDUE H4B A 600
source : AC2

17) chain A
residue 367
type
sequence R
description BINDING SITE FOR RESIDUE H4B A 600
source : AC2

18) chain A
residue 448
type
sequence A
description BINDING SITE FOR RESIDUE H4B A 600
source : AC2

19) chain A
residue 449
type
sequence W
description BINDING SITE FOR RESIDUE H4B A 600
source : AC2

20) chain A
residue 107
type
sequence L
description BINDING SITE FOR RESIDUE 6J0 A 800
source : AC3

21) chain A
residue 249
type
sequence Q
description BINDING SITE FOR RESIDUE 6J0 A 800
source : AC3

22) chain A
residue 336
type
sequence P
description BINDING SITE FOR RESIDUE 6J0 A 800
source : AC3

23) chain A
residue 338
type
sequence V
description BINDING SITE FOR RESIDUE 6J0 A 800
source : AC3

24) chain A
residue 357
type
sequence G
description BINDING SITE FOR RESIDUE 6J0 A 800
source : AC3

25) chain A
residue 477
type
sequence Y
description BINDING SITE FOR RESIDUE 6J0 A 800
source : AC3

26) chain A
residue 188
type
sequence G
description BINDING SITE FOR RESIDUE ACT A 860
source : AC4

27) chain A
residue 358
type
sequence W
description BINDING SITE FOR RESIDUE ACT A 860
source : AC4

28) chain A
residue 420
type
sequence V
description BINDING SITE FOR RESIDUE ACT A 860
source : AC4

29) chain A
residue 428
type
sequence S
description BINDING SITE FOR RESIDUE ACT A 860
source : AC4

30) chain A
residue 248
type
sequence S
description BINDING SITE FOR RESIDUE MTL A 870
source : AC5

31) chain A
residue 252
type
sequence R
description BINDING SITE FOR RESIDUE MTL A 870
source : AC5

32) chain A
residue 268
type
sequence A
description BINDING SITE FOR RESIDUE MTL A 870
source : AC5

33) chain A
residue 269
type
sequence N
description BINDING SITE FOR RESIDUE MTL A 870
source : AC5

34) chain A
residue 271
type
sequence E
description BINDING SITE FOR RESIDUE MTL A 870
source : AC5

35) chain A
residue 272
type
sequence I
description BINDING SITE FOR RESIDUE MTL A 870
source : AC5

36) chain A
residue 340
type
sequence N
description BINDING SITE FOR RESIDUE MTL A 870
source : AC5

37) chain A
residue 480
type
sequence D
description BINDING SITE FOR RESIDUE MTL A 870
source : AC5

38) chain A
residue 106
type
sequence V
description BINDING SITE FOR RESIDUE GOL A 880
source : AC6

39) chain A
residue 367
type
sequence R
description BINDING SITE FOR RESIDUE GOL A 880
source : AC6

40) chain A
residue 373
type
sequence H
description BINDING SITE FOR RESIDUE GOL A 880
source : AC6

41) chain A
residue 449
type
sequence W
description BINDING SITE FOR RESIDUE GOL A 880
source : AC6

42) chain A
residue 85
type
sequence T
description BINDING SITE FOR RESIDUE BME A 960
source : AC7

43) chain A
residue 324
type
sequence W
description BINDING SITE FOR RESIDUE BME A 960
source : AC7

44) chain A
residue 328
type
sequence L
description BINDING SITE FOR RESIDUE BME A 960
source : AC7

45) chain A
residue 384
type
sequence C
description BINDING SITE FOR RESIDUE BME A 960
source : AC7

46) chain A
residue 440
type
sequence R
description BINDING SITE FOR RESIDUE BME A 960
source : AC7

47) chain A
residue 441
type
sequence G
description BINDING SITE FOR RESIDUE BME A 960
source : AC7

48) chain A
residue 447
type
sequence W
description BINDING SITE FOR RESIDUE H4B B 600
source : AC9

49) chain A
residue 462
type
sequence F
description BINDING SITE FOR RESIDUE H4B B 600
source : AC9

50) chain A
residue 465
type
sequence E
description BINDING SITE FOR RESIDUE H4B B 600
source : AC9

51) chain A
residue 76
type
sequence W
description BINDING SITE FOR RESIDUE 6J0 B 800
source : BC1

52) chain A
residue 76
type
sequence W
description BINDING SITE FOR RESIDUE GOL B 880
source : BC4

53) chain A
residue 96
type
sequence C
description BINDING SITE FOR RESIDUE ZN B 900
source : BC5

54) chain A
residue 101
type
sequence C
description BINDING SITE FOR RESIDUE ZN B 900
source : BC5

55) chain A
residue 104
type BINDING
sequence S
description BINDING => ECO:0000250|UniProtKB:P29474
source Swiss-Prot : SWS_FT_FI2

56) chain A
residue 477
type BINDING
sequence Y
description BINDING => ECO:0000250|UniProtKB:P29474
source Swiss-Prot : SWS_FT_FI2

57) chain A
residue 249
type BINDING
sequence Q
description BINDING => ECO:0000250|UniProtKB:P29474
source Swiss-Prot : SWS_FT_FI2

58) chain A
residue 358
type BINDING
sequence W
description BINDING => ECO:0000250|UniProtKB:P29474
source Swiss-Prot : SWS_FT_FI2

59) chain A
residue 359
type BINDING
sequence Y
description BINDING => ECO:0000250|UniProtKB:P29474
source Swiss-Prot : SWS_FT_FI2

60) chain A
residue 363
type BINDING
sequence E
description BINDING => ECO:0000250|UniProtKB:P29474
source Swiss-Prot : SWS_FT_FI2

61) chain A
residue 368
type BINDING
sequence N
description BINDING => ECO:0000250|UniProtKB:P29474
source Swiss-Prot : SWS_FT_FI2

62) chain A
residue 448
type BINDING
sequence A
description BINDING => ECO:0000250|UniProtKB:P29474
source Swiss-Prot : SWS_FT_FI2

63) chain A
residue 449
type BINDING
sequence W
description BINDING => ECO:0000250|UniProtKB:P29474
source Swiss-Prot : SWS_FT_FI2

64) chain A
residue 462
type BINDING
sequence F
description BINDING => ECO:0000250|UniProtKB:P29474
source Swiss-Prot : SWS_FT_FI2

65) chain A
residue 186
type BINDING
sequence C
description axial binding residue => ECO:0000250|UniProtKB:P29474
source Swiss-Prot : SWS_FT_FI3

66) chain A
residue 185-192
type prosite
sequence RCVGRIQW
description NOS Nitric oxide synthase (NOS) signature. RCVGRIqW
source prosite : PS60001

67) chain A
residue 96
type BINDING
sequence C
description BINDING => ECO:0000250|UniProtKB:P35228
source Swiss-Prot : SWS_FT_FI1

68) chain A
residue 101
type BINDING
sequence C
description BINDING => ECO:0000250|UniProtKB:P35228
source Swiss-Prot : SWS_FT_FI1


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