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4KCJ

Structure of neuronal nitric oxide synthase heme domain in complex with N,N'-((ethane-1,2-diylbis(oxy))bis(3,1-phenylene))bis(thiophene-2-carboximidamide)

Functional Information from GO Data
ChainGOidnamespacecontents
A0004517molecular_functionnitric-oxide synthase activity
A0006809biological_processnitric oxide biosynthetic process
B0004517molecular_functionnitric-oxide synthase activity
B0006809biological_processnitric oxide biosynthetic process
Functional Information from PDB Data
site_idAC1
Number of Residues17
DetailsBINDING SITE FOR RESIDUE HEM A 801
ChainResidue
ATRP409
APHE704
ATYR706
AH4B802
AH36804
AHOH918
AHOH924
AHOH931
AHOH951
AARG414
ACYS415
ASER457
APHE584
ASER585
ATRP587
AGLU592
ATRP678

site_idAC2
Number of Residues13
DetailsBINDING SITE FOR RESIDUE H4B A 802
ChainResidue
ASER334
AARG596
AVAL677
ATRP678
AHEM801
AHOH907
AHOH931
AHOH952
AHOH955
BTRP676
BPHE691
BHIS692
BGLU694

site_idAC3
Number of Residues3
DetailsBINDING SITE FOR RESIDUE ACT A 803
ChainResidue
AGLY417
ATRP587
AVAL649

site_idAC4
Number of Residues15
DetailsBINDING SITE FOR RESIDUE H36 A 804
ChainResidue
ASER477
AGLN478
AARG481
APRO565
AVAL567
APHE584
ASER585
AGLY586
ATRP587
AGLU592
ASER602
AARG603
AHEM801
AHOH958
BTRP306

site_idAC5
Number of Residues4
DetailsBINDING SITE FOR RESIDUE ZN A 805
ChainResidue
ACYS326
ACYS331
BCYS326
BCYS331

site_idAC6
Number of Residues16
DetailsBINDING SITE FOR RESIDUE HEM B 801
ChainResidue
BTRP409
BARG414
BCYS415
BSER457
BPHE584
BSER585
BTRP587
BGLU592
BTRP678
BPHE704
BTYR706
BH4B802
BACT803
BH36804
BHOH961
BHOH986

site_idAC7
Number of Residues13
DetailsBINDING SITE FOR RESIDUE H4B B 802
ChainResidue
ATRP676
APHE691
AHIS692
AGLN693
AGLU694
BSER334
BMET336
BARG596
BVAL677
BTRP678
BHEM801
BHOH929
BHOH986

site_idAC8
Number of Residues3
DetailsBINDING SITE FOR RESIDUE ACT B 803
ChainResidue
BGLY417
BTRP587
BHEM801

site_idAC9
Number of Residues16
DetailsBINDING SITE FOR RESIDUE H36 B 804
ChainResidue
BHOH975
ATRP306
BSER477
BGLN478
BARG481
BPRO565
BVAL567
BPHE584
BSER585
BGLY586
BTRP587
BGLU592
BSER602
BARG603
BHEM801
BHOH948

Functional Information from PROSITE/UniProt
site_idPS60001
Number of Residues8
DetailsNOS Nitric oxide synthase (NOS) signature. RCVGRIqW
ChainResidueDetails
AARG414-TRP421

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues18
DetailsBINDING: BINDING => ECO:0000250|UniProtKB:P29475
ChainResidueDetails
ATRP587
ATYR588
AGLU592
AVAL677
ATRP678
APHE691
ATYR706
BSER334
BGLN478
BTRP587
BTYR588
BGLU592
BVAL677
BTRP678
BPHE691
BTYR706
ASER334
AGLN478

site_idSWS_FT_FI2
Number of Residues2
DetailsBINDING: axial binding residue => ECO:0000250|UniProtKB:P29475
ChainResidueDetails
ACYS415
BCYS415

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PDB entries from 2024-06-12

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