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4D3B

Structure of rat neuronal nitric oxide synthase heme domain in complex with N1-(2-(1H-imidazol-1-yl)pyrimidin-4-yl)-N2-(3- fluorophenethyl)ethane-1,2-diamine

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 750
ChainResidue
ATRP409
APHE704
ATYR706
AH4B760
A6J0800
AACT860
AHOH2170
AHOH2243
AHOH2244
ACYS415
ASER457
APHE584
ASER585
AGLY586
ATRP587
AGLU592
ATRP678

site_idAC2
Number of Residues14
DetailsBINDING SITE FOR RESIDUE H4B A 760
ChainResidue
ASER334
AARG596
AVAL677
ATRP678
AHEM750
AHOH2074
AHOH2186
AHOH2224
AHOH2243
AHOH2245
BTRP676
BPHE691
BHIS692
BGLN693

site_idAC3
Number of Residues8
DetailsBINDING SITE FOR RESIDUE 6J0 A 800
ChainResidue
AMET336
ALEU337
AGLN478
APRO565
AVAL567
ATYR706
AHEM750
AHOH2243

site_idAC4
Number of Residues4
DetailsBINDING SITE FOR RESIDUE ACT A 860
ChainResidue
ATRP587
AVAL649
AHEM750
AHOH2210

site_idAC5
Number of Residues17
DetailsBINDING SITE FOR RESIDUE HEM B 750
ChainResidue
BTRP409
BCYS415
BSER457
BPHE584
BSER585
BGLY586
BTRP587
BGLU592
BTRP678
BPHE704
BTYR706
BH4B760
B6J0800
BHOH2244
BHOH2289
BHOH2296
BHOH2297

site_idAC6
Number of Residues14
DetailsBINDING SITE FOR RESIDUE H4B B 760
ChainResidue
ATRP676
APHE691
AHIS692
AGLU694
BSER334
BARG596
BVAL677
BTRP678
BHEM750
BHOH2021
BHOH2022
BHOH2257
BHOH2284
BHOH2297

site_idAC7
Number of Residues10
DetailsBINDING SITE FOR RESIDUE 6J0 B 800
ChainResidue
BMET336
BLEU337
BARG414
BGLN478
BPRO565
BVAL567
BTYR706
BHEM750
BHOH2160
BHOH2297

site_idAC8
Number of Residues6
DetailsBINDING SITE FOR RESIDUE ACT B 860
ChainResidue
BTRP587
BVAL649
BHOH2085
BHOH2088
BHOH2272
BHOH2298

site_idAC9
Number of Residues4
DetailsBINDING SITE FOR RESIDUE ZN A 1717
ChainResidue
ACYS326
ACYS331
BCYS326
BCYS331

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
BTYR706
AGLN478
ATRP587
ATYR588
AGLU592
AVAL677
ATRP678
APHE691
ATYR706

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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