eF-site ID 3nlu-A
PDB Code 3nlu
Chain A

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Title Structure of endothelial nitric oxide synthase heme domain complexed with N1-{(3'R,4'R)-4'-[(6"-amino-4"-methylpyridin-2"-yl)methyl]pyrrolidin-3'-yl}-N2-(3'-fluorophenethyl)ethane-1,2-diamine tetrahydrochloride
Classification OXIDOREDUCTASE
Compound Nitric oxide synthase, endothelial
Source (NOS3_BOVIN)
Sequence A:  GPKFPRVKNWELGSITYDTLCAQSQQDGPCTPRRCLGSLV
LPRPAEQLLSQARDFINQYYSSIKRSGSQAHEERLQEVEA
EVASTGTYHLRESELVFGAKQAWRNAPRCVGRIQWGKLQV
FDARDCSSAQEMFTYICNHIKYATNRGNLRSAITVFPQRA
PGRGDFRIWNSQLVRYAGYRQQDGSVRGDPANVEITELCI
QHGWTPGNGRFDVLPLLLQAPDEAPELFVLPPELVLEVPL
EHPTLEWFAALGLRWYALPAVSNMLLEIGGLEFSAAPFSG
WYMSTEIGTRNLCDPHRYNILEDVAVCMDLDTRTTSSLWK
DKAAVEINLAVLHSFQLAKVTIVDHHAATVSFMKHLDNEQ
KARGGCPADWAWIVPPISGSLTPVFHQEMVNYILSPAFRY
QPDPW
Description


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 228
type
sequence S
description BINDING SITE FOR RESIDUE HEM A 500
source : AC1

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

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

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

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

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

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

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

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

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

14) chain A
residue 358
type
sequence W
description BINDING SITE FOR RESIDUE ACT A 860
source : AC3

15) chain A
residue 428
type
sequence S
description BINDING SITE FOR RESIDUE ACT A 860
source : AC3

16) chain A
residue 367
type
sequence R
description BINDING SITE FOR RESIDUE GOL A 880
source : AC4

17) chain A
residue 373
type
sequence H
description BINDING SITE FOR RESIDUE GOL A 880
source : AC4

18) chain A
residue 249
type
sequence Q
description BINDING SITE FOR RESIDUE 3XB A 800
source : AC5

19) chain A
residue 338
type
sequence V
description BINDING SITE FOR RESIDUE 3XB A 800
source : AC5

20) chain A
residue 355
type
sequence F
description BINDING SITE FOR RESIDUE 3XB A 800
source : AC5

21) chain A
residue 357
type
sequence G
description BINDING SITE FOR RESIDUE 3XB A 800
source : AC5

22) chain A
residue 358
type
sequence W
description BINDING SITE FOR RESIDUE 3XB A 800
source : AC5

23) chain A
residue 359
type
sequence Y
description BINDING SITE FOR RESIDUE 3XB A 800
source : AC5

24) chain A
residue 363
type
sequence E
description BINDING SITE FOR RESIDUE 3XB A 800
source : AC5

25) chain A
residue 449
type
sequence W
description BINDING SITE FOR RESIDUE 3XB A 800
source : AC5

26) chain A
residue 477
type
sequence Y
description BINDING SITE FOR RESIDUE 3XB A 800
source : AC5

27) chain A
residue 384
type
sequence C
description BINDING SITE FOR RESIDUE CAD A 950
source : AC6

28) chain A
residue 439
type
sequence A
description BINDING SITE FOR RESIDUE CAD A 950
source : AC6

29) chain A
residue 440
type
sequence R
description BINDING SITE FOR RESIDUE CAD A 950
source : AC6

30) chain A
residue 441
type
sequence G
description BINDING SITE FOR RESIDUE CAD A 950
source : AC6

31) chain A
residue 96
type
sequence C
description BINDING SITE FOR RESIDUE ZN A 900
source : AC7

32) chain A
residue 101
type
sequence C
description BINDING SITE FOR RESIDUE ZN A 900
source : AC7

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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


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