eF-site ID 3jt7-AB
PDB Code 3jt7
Chain A, B

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Title Structure of neuronal nitric oxide synthase heme domain complexed with N~5~-[2-(propylsulfanyl)ethanimidoyl]-L-ornithine
Classification OXIDOREDUCTASE
Compound Nitric oxide synthase, brain
Source (NOS1_RAT)
Sequence A:  RFLKVKNWETDVVLTDTLHLKSTLETGCTEHICMGSIMLP
TKDQLFPLAKEFLDQYYSSIKRFGSKAHMDRLEEVNKEIE
STSTYQLKDTELIYGAKHAWRNASRCVGRIQWSKLQVFDA
RDCTTAHGMFNYICNHVKYATNKGNLRSAITIFPQRTDGK
HDFRVWNSQLIRYAGYKQPDGSTLGDPANVQFTEICIQQG
WKAPRGRFDVLPLLLQANGNDPELFQIPPELVLEVPIRHP
KFDWFKDLGLKWYGLPAVSNMLLEIGGLEFSACPFSGWYM
GTEIGVRDYCDNSRYNILEEVAKKMDLDMRKTSSLWKDQA
LVEINIAVLYSFQSDKVTIVDHHSATESFIKHMENEYRCR
GGCPADWVWIVPPMSGSITPVFHQEMLNYRLTPSFEYQPD
PWNTHVW
B:  RFLKVKNWETDVVLTDTLHLKSTLETGCTEHICMGSIMLP
VRTKDQLFPLAKEFLDQYYSSIKRFGSKAHMDRLEEVNKE
IESTSTYQLKDTELIYGAKHAWRNASRCVGRIQWSKLQVF
DARDCTTAHGMFNYICNHVKYATNKGNLRSAITIFPQRTD
GKHDFRVWNSQLIRYAGYKQPDGSTLGDPANVQFTEICIQ
QGWKAPRGRFDVLPLLLQANGNDPELFQIPPELVLEVPIR
HPKFDWFKDLGLKWYGLPAVSNMLLEIGGLEFSACPFSGW
YMGTEIGVRDYCDNSRYNILEEVAKKMDLDMRKTSSLWKD
QALVEINIAVLYSFQSDKVTIVDHHSATESFIKHMENEYR
CRGGCPADWVWIVPPMSGSITPVFHQEMLNYRLTPSFEYQ
PDPWNTHVWKG
Description


Functional site

1) chain A
residue 409
type
sequence W
description BINDING SITE FOR RESIDUE HEM A 750
source : AC1

2) chain A
residue 415
type
sequence C
description BINDING SITE FOR RESIDUE HEM A 750
source : AC1

3) chain A
residue 416
type
sequence V
description BINDING SITE FOR RESIDUE HEM A 750
source : AC1

4) chain A
residue 457
type
sequence S
description BINDING SITE FOR RESIDUE HEM A 750
source : AC1

5) chain A
residue 584
type
sequence F
description BINDING SITE FOR RESIDUE HEM A 750
source : AC1

6) chain A
residue 585
type
sequence S
description BINDING SITE FOR RESIDUE HEM A 750
source : AC1

7) chain A
residue 587
type
sequence W
description BINDING SITE FOR RESIDUE HEM A 750
source : AC1

8) chain A
residue 592
type
sequence E
description BINDING SITE FOR RESIDUE HEM A 750
source : AC1

9) chain A
residue 678
type
sequence W
description BINDING SITE FOR RESIDUE HEM A 750
source : AC1

10) chain A
residue 704
type
sequence F
description BINDING SITE FOR RESIDUE HEM A 750
source : AC1

11) chain A
residue 706
type
sequence Y
description BINDING SITE FOR RESIDUE HEM A 750
source : AC1

12) chain A
residue 334
type
sequence S
description BINDING SITE FOR RESIDUE H4B A 760
source : AC2

13) chain A
residue 596
type
sequence R
description BINDING SITE FOR RESIDUE H4B A 760
source : AC2

14) chain A
residue 677
type
sequence V
description BINDING SITE FOR RESIDUE H4B A 760
source : AC2

15) chain A
residue 678
type
sequence W
description BINDING SITE FOR RESIDUE H4B A 760
source : AC2

16) chain B
residue 676
type
sequence W
description BINDING SITE FOR RESIDUE H4B A 760
source : AC2

17) chain B
residue 691
type
sequence F
description BINDING SITE FOR RESIDUE H4B A 760
source : AC2

18) chain B
residue 692
type
sequence H
description BINDING SITE FOR RESIDUE H4B A 760
source : AC2

19) chain B
residue 693
type
sequence Q
description BINDING SITE FOR RESIDUE H4B A 760
source : AC2

20) chain B
residue 694
type
sequence E
description BINDING SITE FOR RESIDUE H4B A 760
source : AC2

21) chain A
residue 478
type
sequence Q
description BINDING SITE FOR RESIDUE JM5 A 800
source : AC3

22) chain A
residue 562
type
sequence Y
description BINDING SITE FOR RESIDUE JM5 A 800
source : AC3

23) chain A
residue 565
type
sequence P
description BINDING SITE FOR RESIDUE JM5 A 800
source : AC3

24) chain A
residue 566
type
sequence A
description BINDING SITE FOR RESIDUE JM5 A 800
source : AC3

25) chain A
residue 567
type
sequence V
description BINDING SITE FOR RESIDUE JM5 A 800
source : AC3

26) chain A
residue 584
type
sequence F
description BINDING SITE FOR RESIDUE JM5 A 800
source : AC3

27) chain A
residue 585
type
sequence S
description BINDING SITE FOR RESIDUE JM5 A 800
source : AC3

28) chain A
residue 586
type
sequence G
description BINDING SITE FOR RESIDUE JM5 A 800
source : AC3

29) chain A
residue 587
type
sequence W
description BINDING SITE FOR RESIDUE JM5 A 800
source : AC3

30) chain A
residue 588
type
sequence Y
description BINDING SITE FOR RESIDUE JM5 A 800
source : AC3

31) chain A
residue 592
type
sequence E
description BINDING SITE FOR RESIDUE JM5 A 800
source : AC3

32) chain A
residue 597
type
sequence D
description BINDING SITE FOR RESIDUE JM5 A 800
source : AC3

33) chain A
residue 587
type
sequence W
description BINDING SITE FOR RESIDUE ACT A 860
source : AC4

34) chain A
residue 649
type
sequence V
description BINDING SITE FOR RESIDUE ACT A 860
source : AC4

35) chain A
residue 657
type
sequence S
description BINDING SITE FOR RESIDUE ACT A 860
source : AC4

36) chain A
residue 326
type
sequence C
description BINDING SITE FOR RESIDUE ZN A 900
source : AC5

37) chain A
residue 331
type
sequence C
description BINDING SITE FOR RESIDUE ZN A 900
source : AC5

38) chain B
residue 326
type
sequence C
description BINDING SITE FOR RESIDUE ZN A 900
source : AC5

39) chain B
residue 331
type
sequence C
description BINDING SITE FOR RESIDUE ZN A 900
source : AC5

40) chain B
residue 409
type
sequence W
description BINDING SITE FOR RESIDUE HEM B 750
source : AC6

41) chain B
residue 415
type
sequence C
description BINDING SITE FOR RESIDUE HEM B 750
source : AC6

42) chain B
residue 457
type
sequence S
description BINDING SITE FOR RESIDUE HEM B 750
source : AC6

43) chain B
residue 584
type
sequence F
description BINDING SITE FOR RESIDUE HEM B 750
source : AC6

44) chain B
residue 585
type
sequence S
description BINDING SITE FOR RESIDUE HEM B 750
source : AC6

45) chain B
residue 587
type
sequence W
description BINDING SITE FOR RESIDUE HEM B 750
source : AC6

46) chain B
residue 592
type
sequence E
description BINDING SITE FOR RESIDUE HEM B 750
source : AC6

47) chain B
residue 678
type
sequence W
description BINDING SITE FOR RESIDUE HEM B 750
source : AC6

48) chain B
residue 704
type
sequence F
description BINDING SITE FOR RESIDUE HEM B 750
source : AC6

49) chain B
residue 706
type
sequence Y
description BINDING SITE FOR RESIDUE HEM B 750
source : AC6

50) chain A
residue 676
type
sequence W
description BINDING SITE FOR RESIDUE H4B B 760
source : AC7

51) chain A
residue 691
type
sequence F
description BINDING SITE FOR RESIDUE H4B B 760
source : AC7

52) chain A
residue 692
type
sequence H
description BINDING SITE FOR RESIDUE H4B B 760
source : AC7

53) chain A
residue 693
type
sequence Q
description BINDING SITE FOR RESIDUE H4B B 760
source : AC7

54) chain A
residue 694
type
sequence E
description BINDING SITE FOR RESIDUE H4B B 760
source : AC7

55) chain B
residue 334
type
sequence S
description BINDING SITE FOR RESIDUE H4B B 760
source : AC7

56) chain B
residue 596
type
sequence R
description BINDING SITE FOR RESIDUE H4B B 760
source : AC7

57) chain B
residue 677
type
sequence V
description BINDING SITE FOR RESIDUE H4B B 760
source : AC7

58) chain B
residue 678
type
sequence W
description BINDING SITE FOR RESIDUE H4B B 760
source : AC7

59) chain B
residue 478
type
sequence Q
description BINDING SITE FOR RESIDUE JM5 B 800
source : AC8

60) chain B
residue 562
type
sequence Y
description BINDING SITE FOR RESIDUE JM5 B 800
source : AC8

61) chain B
residue 565
type
sequence P
description BINDING SITE FOR RESIDUE JM5 B 800
source : AC8

62) chain B
residue 567
type
sequence V
description BINDING SITE FOR RESIDUE JM5 B 800
source : AC8

63) chain B
residue 584
type
sequence F
description BINDING SITE FOR RESIDUE JM5 B 800
source : AC8

64) chain B
residue 586
type
sequence G
description BINDING SITE FOR RESIDUE JM5 B 800
source : AC8

65) chain B
residue 587
type
sequence W
description BINDING SITE FOR RESIDUE JM5 B 800
source : AC8

66) chain B
residue 588
type
sequence Y
description BINDING SITE FOR RESIDUE JM5 B 800
source : AC8

67) chain B
residue 592
type
sequence E
description BINDING SITE FOR RESIDUE JM5 B 800
source : AC8

68) chain B
residue 597
type
sequence D
description BINDING SITE FOR RESIDUE JM5 B 800
source : AC8

69) chain B
residue 587
type
sequence W
description BINDING SITE FOR RESIDUE ACT B 860
source : AC9

70) chain B
residue 649
type
sequence V
description BINDING SITE FOR RESIDUE ACT B 860
source : AC9

71) chain A
residue 414-421
type prosite
sequence RCVGRIQW
description NOS Nitric oxide synthase (NOS) signature. RCVGRIqW
source prosite : PS60001

72) chain A
residue 334
type BINDING
sequence S
description BINDING => ECO:0000250|UniProtKB:P29475
source Swiss-Prot : SWS_FT_FI1

73) chain B
residue 334
type BINDING
sequence S
description BINDING => ECO:0000250|UniProtKB:P29475
source Swiss-Prot : SWS_FT_FI1

74) chain B
residue 478
type BINDING
sequence Q
description BINDING => ECO:0000250|UniProtKB:P29475
source Swiss-Prot : SWS_FT_FI1

75) chain B
residue 587
type BINDING
sequence W
description BINDING => ECO:0000250|UniProtKB:P29475
source Swiss-Prot : SWS_FT_FI1

76) chain B
residue 588
type BINDING
sequence Y
description BINDING => ECO:0000250|UniProtKB:P29475
source Swiss-Prot : SWS_FT_FI1

77) chain B
residue 592
type BINDING
sequence E
description BINDING => ECO:0000250|UniProtKB:P29475
source Swiss-Prot : SWS_FT_FI1

78) chain B
residue 677
type BINDING
sequence V
description BINDING => ECO:0000250|UniProtKB:P29475
source Swiss-Prot : SWS_FT_FI1

79) chain B
residue 678
type BINDING
sequence W
description BINDING => ECO:0000250|UniProtKB:P29475
source Swiss-Prot : SWS_FT_FI1

80) chain B
residue 691
type BINDING
sequence F
description BINDING => ECO:0000250|UniProtKB:P29475
source Swiss-Prot : SWS_FT_FI1

81) chain B
residue 706
type BINDING
sequence Y
description BINDING => ECO:0000250|UniProtKB:P29475
source Swiss-Prot : SWS_FT_FI1

82) chain A
residue 478
type BINDING
sequence Q
description BINDING => ECO:0000250|UniProtKB:P29475
source Swiss-Prot : SWS_FT_FI1

83) chain A
residue 587
type BINDING
sequence W
description BINDING => ECO:0000250|UniProtKB:P29475
source Swiss-Prot : SWS_FT_FI1

84) chain A
residue 588
type BINDING
sequence Y
description BINDING => ECO:0000250|UniProtKB:P29475
source Swiss-Prot : SWS_FT_FI1

85) chain A
residue 592
type BINDING
sequence E
description BINDING => ECO:0000250|UniProtKB:P29475
source Swiss-Prot : SWS_FT_FI1

86) chain A
residue 677
type BINDING
sequence V
description BINDING => ECO:0000250|UniProtKB:P29475
source Swiss-Prot : SWS_FT_FI1

87) chain A
residue 678
type BINDING
sequence W
description BINDING => ECO:0000250|UniProtKB:P29475
source Swiss-Prot : SWS_FT_FI1

88) chain A
residue 691
type BINDING
sequence F
description BINDING => ECO:0000250|UniProtKB:P29475
source Swiss-Prot : SWS_FT_FI1

89) chain A
residue 706
type BINDING
sequence Y
description BINDING => ECO:0000250|UniProtKB:P29475
source Swiss-Prot : SWS_FT_FI1

90) chain A
residue 415
type BINDING
sequence C
description axial binding residue => ECO:0000250|UniProtKB:P29475
source Swiss-Prot : SWS_FT_FI2

91) chain B
residue 415
type BINDING
sequence C
description axial binding residue => ECO:0000250|UniProtKB:P29475
source Swiss-Prot : SWS_FT_FI2


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