eF-site ID 1d1y-AB
PDB Code 1d1y
Chain A, B

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Title BOVINE ENDOTHELIAL NITRIC OXIDE SYNTHASE HEME DOMAIN COMPLEXED WITH 1,3-PBITU (H4B FREE)
Classification OXIDOREDUCTASE
Compound BOVINE ENDOTHELIAL NITRIC OXIDE SYNTHASE HEME DOMAIN
Source Bos taurus (Bovine) (NOS3_BOVIN)
Sequence A:  GPKFPRVKNWELGSITYDTLCAQSQQDGPCTPRRCLGSLV
LPRKLQTRPSPGPPPAEQLLSQARDFINQYYSSIKRSGSQ
AHEERLQEVEAEVASTGTYHLRESELVFGAKQAWRNAPRC
VGRIQWGKLQVFDARDCSSAQEMFTYICNHIKYATNRGNL
RSAITVFPQRAPGRGDFRIWNSQLVRYAGYRQQDGSVRGD
PANVEITELCIQHGWTPGNGRFDVLPLLLQAPDEAPELFV
LPPELVLEVPLEHPTLEWFAALGLRWYALPAVSNMLLEIG
GLEFSAAPFSGWYMSTEIGTRNLCDPHRYNILEDVAVCMD
LDTRTTSSLWKDKAAVEINLAVLHSFQLAKVTIVDHHAAT
VSFMKHLDNEQKARGGCPADWAWIVPPISGSLTPVFHQEM
VNYILSPAFRYQPDPW
B:  KFPRVKNWELGSITYDTLCAQSQQDGPCTPRRCLGSLVLP
RKLQTRPSPGPPPAEQLLSQARDFINQYYSSIKRSGSQAH
EERLQEVEAEVASTGTYHLRESELVFGAKQAWRNAPRCVG
RIQWGKLQVFDARDCSSAQEMFTYICNHIKYATNRGNLRS
AITVFPQRAPGRGDFRIWNSQLVRYAGYRQQDGSVRGDPA
NVEITELCIQHGWTPGNGRFDVLPLLLQAPDEAPELFVLP
PELVLEVPLEHPTLEWFAALGLRWYALPAVSNMLLEIGGL
EFSAAPFSGWYMSTEIGTRNLCDPHRYNILEDVAVCMDLD
TRTTSSLWKDKAAVEINLAVLHSFQLAKVTIVDHHAATVS
FMKHLDNEQKARGGCPADWAWIVPPISGSLTPVFHQEMVN
YILSPAFRYQPDPW
Description


Functional site

1) chain A
residue 249
type
sequence Q
description BINDING SITE FOR RESIDUE ACT A 850
source : AC1

2) chain A
residue 252
type
sequence R
description BINDING SITE FOR RESIDUE ACT A 850
source : AC1

3) chain A
residue 368
type
sequence N
description BINDING SITE FOR RESIDUE ACT A 850
source : AC1

4) chain A
residue 374
type
sequence R
description BINDING SITE FOR RESIDUE ACT A 850
source : AC1

5) chain A
residue 188
type
sequence G
description BINDING SITE FOR RESIDUE ACT A 860
source : AC2

6) chain A
residue 358
type
sequence W
description BINDING SITE FOR RESIDUE ACT A 860
source : AC2

7) chain A
residue 420
type
sequence V
description BINDING SITE FOR RESIDUE ACT A 860
source : AC2

8) chain A
residue 428
type
sequence S
description BINDING SITE FOR RESIDUE ACT A 860
source : AC2

9) chain B
residue 249
type
sequence Q
description BINDING SITE FOR RESIDUE ACT B 851
source : AC3

10) chain B
residue 252
type
sequence R
description BINDING SITE FOR RESIDUE ACT B 851
source : AC3

11) chain B
residue 368
type
sequence N
description BINDING SITE FOR RESIDUE ACT B 851
source : AC3

12) chain B
residue 374
type
sequence R
description BINDING SITE FOR RESIDUE ACT B 851
source : AC3

13) chain B
residue 188
type
sequence G
description BINDING SITE FOR RESIDUE ACT B 861
source : AC4

14) chain B
residue 358
type
sequence W
description BINDING SITE FOR RESIDUE ACT B 861
source : AC4

15) chain B
residue 420
type
sequence V
description BINDING SITE FOR RESIDUE ACT B 861
source : AC4

16) chain B
residue 428
type
sequence S
description BINDING SITE FOR RESIDUE ACT B 861
source : AC4

17) chain A
residue 96
type
sequence C
description BINDING SITE FOR RESIDUE ZN B 900
source : AC5

18) chain A
residue 101
type
sequence C
description BINDING SITE FOR RESIDUE ZN B 900
source : AC5

19) chain B
residue 96
type
sequence C
description BINDING SITE FOR RESIDUE ZN B 900
source : AC5

20) chain B
residue 101
type
sequence C
description BINDING SITE FOR RESIDUE ZN B 900
source : AC5

21) chain A
residue 180
type
sequence W
description BINDING SITE FOR RESIDUE HEM A 500
source : AC6

22) chain A
residue 185
type
sequence R
description BINDING SITE FOR RESIDUE HEM A 500
source : AC6

23) chain A
residue 186
type
sequence C
description BINDING SITE FOR RESIDUE HEM A 500
source : AC6

24) chain A
residue 228
type
sequence S
description BINDING SITE FOR RESIDUE HEM A 500
source : AC6

25) chain A
residue 341
type
sequence M
description BINDING SITE FOR RESIDUE HEM A 500
source : AC6

26) chain A
residue 355
type
sequence F
description BINDING SITE FOR RESIDUE HEM A 500
source : AC6

27) chain A
residue 356
type
sequence S
description BINDING SITE FOR RESIDUE HEM A 500
source : AC6

28) chain A
residue 358
type
sequence W
description BINDING SITE FOR RESIDUE HEM A 500
source : AC6

29) chain A
residue 363
type
sequence E
description BINDING SITE FOR RESIDUE HEM A 500
source : AC6

30) chain A
residue 449
type
sequence W
description BINDING SITE FOR RESIDUE HEM A 500
source : AC6

31) chain A
residue 477
type
sequence Y
description BINDING SITE FOR RESIDUE HEM A 500
source : AC6

32) chain B
residue 180
type
sequence W
description BINDING SITE FOR RESIDUE HEM B 500
source : AC7

33) chain B
residue 185
type
sequence R
description BINDING SITE FOR RESIDUE HEM B 500
source : AC7

34) chain B
residue 186
type
sequence C
description BINDING SITE FOR RESIDUE HEM B 500
source : AC7

35) chain B
residue 228
type
sequence S
description BINDING SITE FOR RESIDUE HEM B 500
source : AC7

36) chain B
residue 355
type
sequence F
description BINDING SITE FOR RESIDUE HEM B 500
source : AC7

37) chain B
residue 356
type
sequence S
description BINDING SITE FOR RESIDUE HEM B 500
source : AC7

38) chain B
residue 358
type
sequence W
description BINDING SITE FOR RESIDUE HEM B 500
source : AC7

39) chain B
residue 363
type
sequence E
description BINDING SITE FOR RESIDUE HEM B 500
source : AC7

40) chain B
residue 449
type
sequence W
description BINDING SITE FOR RESIDUE HEM B 500
source : AC7

41) chain B
residue 477
type
sequence Y
description BINDING SITE FOR RESIDUE HEM B 500
source : AC7

42) chain A
residue 248
type
sequence S
description BINDING SITE FOR RESIDUE 3BT A 820
source : AC8

43) chain A
residue 249
type
sequence Q
description BINDING SITE FOR RESIDUE 3BT A 820
source : AC8

44) chain A
residue 336
type
sequence P
description BINDING SITE FOR RESIDUE 3BT A 820
source : AC8

45) chain A
residue 338
type
sequence V
description BINDING SITE FOR RESIDUE 3BT A 820
source : AC8

46) chain A
residue 355
type
sequence F
description BINDING SITE FOR RESIDUE 3BT A 820
source : AC8

47) chain A
residue 358
type
sequence W
description BINDING SITE FOR RESIDUE 3BT A 820
source : AC8

48) chain A
residue 359
type
sequence Y
description BINDING SITE FOR RESIDUE 3BT A 820
source : AC8

49) chain A
residue 363
type
sequence E
description BINDING SITE FOR RESIDUE 3BT A 820
source : AC8

50) chain A
residue 367
type
sequence R
description BINDING SITE FOR RESIDUE EDO A 870
source : AC9

51) chain A
residue 373
type
sequence H
description BINDING SITE FOR RESIDUE EDO A 870
source : AC9

52) chain B
residue 76
type
sequence W
description BINDING SITE FOR RESIDUE EDO A 870
source : AC9

53) chain A
residue 324
type
sequence W
description BINDING SITE FOR RESIDUE CAD A 950
source : BC1

54) chain A
residue 384
type
sequence C
description BINDING SITE FOR RESIDUE CAD A 950
source : BC1

55) chain A
residue 438
type
sequence K
description BINDING SITE FOR RESIDUE CAD A 950
source : BC1

56) chain A
residue 440
type
sequence R
description BINDING SITE FOR RESIDUE CAD A 950
source : BC1

57) chain A
residue 441
type
sequence G
description BINDING SITE FOR RESIDUE CAD A 950
source : BC1

58) chain B
residue 249
type
sequence Q
description BINDING SITE FOR RESIDUE 3BT B 821
source : BC2

59) chain B
residue 336
type
sequence P
description BINDING SITE FOR RESIDUE 3BT B 821
source : BC2

60) chain B
residue 338
type
sequence V
description BINDING SITE FOR RESIDUE 3BT B 821
source : BC2

61) chain B
residue 340
type
sequence N
description BINDING SITE FOR RESIDUE 3BT B 821
source : BC2

62) chain B
residue 358
type
sequence W
description BINDING SITE FOR RESIDUE 3BT B 821
source : BC2

63) chain B
residue 359
type
sequence Y
description BINDING SITE FOR RESIDUE 3BT B 821
source : BC2

64) chain B
residue 363
type
sequence E
description BINDING SITE FOR RESIDUE 3BT B 821
source : BC2

65) chain B
residue 367
type
sequence R
description BINDING SITE FOR RESIDUE EDO B 871
source : BC3

66) chain B
residue 373
type
sequence H
description BINDING SITE FOR RESIDUE EDO B 871
source : BC3

67) chain B
residue 70
type
sequence F
description BINDING SITE FOR RESIDUE CAD B 951
source : BC4

68) chain B
residue 83
type
sequence Y
description BINDING SITE FOR RESIDUE CAD B 951
source : BC4

69) chain B
residue 324
type
sequence W
description BINDING SITE FOR RESIDUE CAD B 951
source : BC4

70) chain B
residue 384
type
sequence C
description BINDING SITE FOR RESIDUE CAD B 951
source : BC4

71) chain A
residue 367
type
sequence R
description BINDING SITE FOR RESIDUE GOL A 890
source : BC5

72) chain A
residue 449
type
sequence W
description BINDING SITE FOR RESIDUE GOL A 890
source : BC5

73) chain B
residue 462
type
sequence F
description BINDING SITE FOR RESIDUE GOL A 890
source : BC5

74) chain A
residue 462
type
sequence F
description BINDING SITE FOR RESIDUE GOL A 881
source : BC6

75) chain A
residue 465
type
sequence E
description BINDING SITE FOR RESIDUE GOL A 881
source : BC6

76) chain B
residue 104
type
sequence S
description BINDING SITE FOR RESIDUE GOL A 881
source : BC6

77) chain B
residue 449
type
sequence W
description BINDING SITE FOR RESIDUE GOL A 881
source : BC6

78) chain B
residue 367
type
sequence R
description BINDING SITE FOR RESIDUE GOL B 891
source : BC7

79) chain B
residue 448
type
sequence A
description BINDING SITE FOR RESIDUE GOL B 891
source : BC7

80) chain B
residue 449
type
sequence W
description BINDING SITE FOR RESIDUE GOL B 891
source : BC7

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

108) chain A
residue 116
type MOD_RES
sequence S
description Phosphoserine; by CDK5 => ECO:0000250|UniProtKB:P29474
source Swiss-Prot : SWS_FT_FI4

109) chain B
residue 116
type MOD_RES
sequence S
description Phosphoserine; by CDK5 => ECO:0000250|UniProtKB:P29474
source Swiss-Prot : SWS_FT_FI4


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