eF-site ID 5adc-AB
PDB Code 5adc
Chain A, B

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Title Structure of rat neuronal nitric oxide synthase heme domain in complex with 7-(((5-((Methylamino)methyl)pyridin-3-yl)oxy)methyl) quinolin-2-amine
Classification OXIDOREDUCTASE
Compound NITRIC OXIDE SYNTHASE, BRAIN
Source Rattus norvegicus (Rat) (NOS1_RAT)
Sequence A:  RFLKVKNWETDVVLTDTLHLKSTLETGCTEHICMGSIMLP
TKDQLFPLAKEFLDQYYSSIKRFGSKAHMDRLEEVNKEIE
STSTYQLKDTELIYGAKHAWRNASRCVGRIQWSKLQVFDA
RDCTTAHGMFNYICNHVKYATNKGNLRSAITIFPQRTDGK
HDFRVWNSQLIRYAGYKQPDGSTLGDPANVQFTEICIQQG
WKAPRGRFDVLPLLLQANGNDPELFQIPPELVLEVPIRHP
KFDWFKDLGLKWYGLPAVSNMLLEIGGLEFSACPFSGWYM
GTEIGVRDYCDNSRYNILEEVAKKMDLDMRKTSSLWKDQA
LVEINIAVLYSFQSDKVTIVDHHSATESFIKHMENEYRCR
GGCPADWVWIVPPMSGSITPVFHQEMLNYRLTPSFEYQPD
PWNTHVWK
B:  RFLKVKNWETDVVLTDTLHLKSTLETGCTEHICMGSIMLP
VRTKDQLFPLAKEFLDQYYSSIKRFGSKAHMDRLEEVNKE
IESTSTYQLKDTELIYGAKHAWRNASRCVGRIQWSKLQVF
DARDCTTAHGMFNYICNHVKYATNKGNLRSAITIFPQRTD
GKHDFRVWNSQLIRYAGYKQPDGSTLGDPANVQFTEICIQ
QGWKAPRGRFDVLPLLLQANGNDPELFQIPPELVLEVPIR
HPKFDWFKDLGLKWYGLPAVSNMLLEIGGLEFSACPFSGW
YMGTEIGVRDYCDNSRYNILEEVAKKMDLDMRKTSSLWKD
QALVEINIAVLYSFQSDKVTIVDHHSATESFIKHMENEYR
CRGGCPADWVWIVPPMSGSITPVFHQEMLNYRLTPSFEYQ
PDPWNTHVWKG
Description (1)  NITRIC OXIDE SYNTHASE, BRAIN (E.C.1.14.13.39)


Functional site

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

2) chain A
residue 414
type
sequence R
description BINDING SITE FOR RESIDUE HEM A 750
source : AC1

3) chain A
residue 415
type
sequence C
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 586
type
sequence G
description BINDING SITE FOR RESIDUE HEM A 750
source : AC1

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

9) chain A
residue 589
type
sequence M
description BINDING SITE FOR RESIDUE HEM A 750
source : AC1

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

29) chain A
residue 678
type
sequence W
description BINDING SITE FOR RESIDUE TUE A 800
source : AC3

30) chain A
residue 706
type
sequence Y
description BINDING SITE FOR RESIDUE TUE A 800
source : AC3

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

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

33) chain B
residue 409
type
sequence W
description BINDING SITE FOR RESIDUE HEM B 750
source : AC5

34) chain B
residue 412
type
sequence A
description BINDING SITE FOR RESIDUE HEM B 750
source : AC5

35) chain B
residue 414
type
sequence R
description BINDING SITE FOR RESIDUE HEM B 750
source : AC5

36) chain B
residue 415
type
sequence C
description BINDING SITE FOR RESIDUE HEM B 750
source : AC5

37) chain B
residue 457
type
sequence S
description BINDING SITE FOR RESIDUE HEM B 750
source : AC5

38) chain B
residue 584
type
sequence F
description BINDING SITE FOR RESIDUE HEM B 750
source : AC5

39) chain B
residue 585
type
sequence S
description BINDING SITE FOR RESIDUE HEM B 750
source : AC5

40) chain B
residue 586
type
sequence G
description BINDING SITE FOR RESIDUE HEM B 750
source : AC5

41) chain B
residue 587
type
sequence W
description BINDING SITE FOR RESIDUE HEM B 750
source : AC5

42) chain B
residue 592
type
sequence E
description BINDING SITE FOR RESIDUE HEM B 750
source : AC5

43) chain B
residue 678
type
sequence W
description BINDING SITE FOR RESIDUE HEM B 750
source : AC5

44) chain B
residue 704
type
sequence F
description BINDING SITE FOR RESIDUE HEM B 750
source : AC5

45) chain B
residue 706
type
sequence Y
description BINDING SITE FOR RESIDUE HEM B 750
source : AC5

46) chain A
residue 676
type
sequence W
description BINDING SITE FOR RESIDUE H4B B 760
source : AC6

47) chain A
residue 691
type
sequence F
description BINDING SITE FOR RESIDUE H4B B 760
source : AC6

48) chain A
residue 692
type
sequence H
description BINDING SITE FOR RESIDUE H4B B 760
source : AC6

49) chain A
residue 693
type
sequence Q
description BINDING SITE FOR RESIDUE H4B B 760
source : AC6

50) chain A
residue 694
type
sequence E
description BINDING SITE FOR RESIDUE H4B B 760
source : AC6

51) chain B
residue 334
type
sequence S
description BINDING SITE FOR RESIDUE H4B B 760
source : AC6

52) chain B
residue 336
type
sequence M
description BINDING SITE FOR RESIDUE H4B B 760
source : AC6

53) chain B
residue 596
type
sequence R
description BINDING SITE FOR RESIDUE H4B B 760
source : AC6

54) chain B
residue 677
type
sequence V
description BINDING SITE FOR RESIDUE H4B B 760
source : AC6

55) chain B
residue 678
type
sequence W
description BINDING SITE FOR RESIDUE H4B B 760
source : AC6

56) chain B
residue 567
type
sequence V
description BINDING SITE FOR RESIDUE TUE B 800
source : AC7

57) chain B
residue 587
type
sequence W
description BINDING SITE FOR RESIDUE TUE B 800
source : AC7

58) chain B
residue 588
type
sequence Y
description BINDING SITE FOR RESIDUE TUE B 800
source : AC7

59) chain B
residue 592
type
sequence E
description BINDING SITE FOR RESIDUE TUE B 800
source : AC7

60) chain B
residue 420
type
sequence Q
description BINDING SITE FOR RESIDUE ACT B 860
source : AC8

61) chain B
residue 587
type
sequence W
description BINDING SITE FOR RESIDUE ACT B 860
source : AC8

62) chain B
residue 649
type
sequence V
description BINDING SITE FOR RESIDUE ACT B 860
source : AC8

63) chain A
residue 326
type
sequence C
description BINDING SITE FOR RESIDUE ZN A 1717
source : AC9

64) chain A
residue 331
type
sequence C
description BINDING SITE FOR RESIDUE ZN A 1717
source : AC9

65) chain B
residue 326
type
sequence C
description BINDING SITE FOR RESIDUE ZN A 1717
source : AC9

66) chain B
residue 331
type
sequence C
description BINDING SITE FOR RESIDUE ZN A 1717
source : AC9

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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


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