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3JX6

Structure of neuronal nitric oxide synthase D597N/M336V/Y706A mutant 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

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 Residues12
DetailsBINDING SITE FOR RESIDUE HEM A 750
ChainResidue
ATRP409
AHOH1034
AHOH1037
AHOH1055
ACYS415
APHE584
ASER585
ATRP587
APHE704
AH4B760
AJI5800
AACT860

site_idAC2
Number of Residues12
DetailsBINDING SITE FOR RESIDUE H4B A 760
ChainResidue
ASER334
AARG596
AVAL677
ATRP678
AHEM750
AJI5800
AHOH1070
BTRP676
BPHE691
BHIS692
BGLN693
BGLU694

site_idAC3
Number of Residues9
DetailsBINDING SITE FOR RESIDUE JI5 A 800
ChainResidue
AGLN478
ASER585
AGLY586
ATRP587
AGLU592
ATRP678
AHEM750
AH4B760
AHOH1034

site_idAC4
Number of Residues2
DetailsBINDING SITE FOR RESIDUE ACT A 860
ChainResidue
ATRP587
AHEM750

site_idAC5
Number of Residues4
DetailsBINDING SITE FOR RESIDUE ZN A 900
ChainResidue
ACYS326
ACYS331
BCYS326
BCYS331

site_idAC6
Number of Residues11
DetailsBINDING SITE FOR RESIDUE HEM B 750
ChainResidue
BTRP409
BCYS415
BMET570
BPHE584
BSER585
BTRP587
BGLU592
BPHE704
BH4B761
BJI5800
BACT861

site_idAC7
Number of Residues11
DetailsBINDING SITE FOR RESIDUE H4B B 761
ChainResidue
ATRP676
APHE691
AGLU694
BSER334
BARG596
BVAL677
BTRP678
BHEM750
BJI5800
BHOH1000
BHOH1060

site_idAC8
Number of Residues9
DetailsBINDING SITE FOR RESIDUE JI5 B 800
ChainResidue
ATRP306
BVAL336
BGLY586
BTRP587
BGLU592
BTRP678
BHEM750
BH4B761
BHOH1057

site_idAC9
Number of Residues5
DetailsBINDING SITE FOR RESIDUE ACT B 861
ChainResidue
BTRP587
BHEM750
BHOH1045
BHOH1102
BHOH1104

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
ASER334
BSER334
BGLN478
BTRP587
BTYR588
BGLU592
BVAL677
BTRP678
BPHE691
BALA706
AGLN478
ATRP587
ATYR588
AGLU592
AVAL677
ATRP678
APHE691
AALA706

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 2024-07-24

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