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4D37

Structure of bovine endothelial nitric oxide synthase heme domain in complex with N-{[(1R,2R)-2-(3-fluorophenyl)cyclopropyl]methyl}-2-[2-(1H-imidazol-1-yl) pyrimidin-4-yl]ethanamine

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 Residues16
DetailsBINDING SITE FOR RESIDUE HEM A 500
ChainResidue
ATRP180
ATRP449
APHE475
ATYR477
AH4B600
A9HL800
AHOH2193
AHOH2194
AARG185
ACYS186
ASER228
APHE355
ASER356
ATRP358
AMET360
AGLU363

site_idAC2
Number of Residues15
DetailsBINDING SITE FOR RESIDUE H4B A 600
ChainResidue
ASER104
AARG367
AALA448
ATRP449
AHEM500
AGOL880
AHOH2025
AHOH2143
AHOH2177
AHOH2194
BTRP447
BPHE462
BHIS463
BGLN464
BGLU465

site_idAC3
Number of Residues10
DetailsBINDING SITE FOR RESIDUE 9HL A 800
ChainResidue
AVAL106
ALEU107
AGLN249
APRO336
AVAL338
ATRP449
AHEM500
AGOL880
AHOH2194
BTRP76

site_idAC4
Number of Residues2
DetailsBINDING SITE FOR RESIDUE ACT A 860
ChainResidue
ATRP358
ASER428

site_idAC5
Number of Residues5
DetailsBINDING SITE FOR RESIDUE GOL A 880
ChainResidue
AARG367
AHIS373
AH4B600
A9HL800
AHOH2143

site_idAC6
Number of Residues17
DetailsBINDING SITE FOR RESIDUE HEM B 500
ChainResidue
BTRP180
BARG185
BCYS186
BGLY188
BSER228
BPHE355
BSER356
BTRP358
BGLU363
BTRP449
BPHE475
BTYR477
BH4B600
B9HL800
BHOH2153
BHOH2154
BHOH2155

site_idAC7
Number of Residues14
DetailsBINDING SITE FOR RESIDUE H4B B 600
ChainResidue
ATRP447
APHE462
AHOH2184
BSER104
BARG367
BALA448
BTRP449
BHEM500
BGOL880
BHOH2021
BHOH2122
BHOH2143
BHOH2144
BHOH2154

site_idAC8
Number of Residues8
DetailsBINDING SITE FOR RESIDUE 9HL B 800
ChainResidue
ATRP76
BLEU107
BGLN249
BPRO336
BVAL338
BTRP449
BHEM500
BGOL880

site_idAC9
Number of Residues6
DetailsBINDING SITE FOR RESIDUE ACT B 860
ChainResidue
BGLY188
BTRP358
BVAL420
BSER428
BHOH2052
BHOH2156

site_idBC1
Number of Residues6
DetailsBINDING SITE FOR RESIDUE GOL B 880
ChainResidue
AHOH2184
BVAL106
BARG367
BHIS373
BH4B600
B9HL800

site_idBC2
Number of Residues4
DetailsBINDING SITE FOR RESIDUE ZN A 1483
ChainResidue
ACYS96
ACYS101
BCYS96
BCYS101

Functional Information from PROSITE/UniProt
site_idPS60001
Number of Residues8
DetailsNOS Nitric oxide synthase (NOS) signature. RCVGRIqW
ChainResidueDetails
AARG185-TRP192

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues4
DetailsBINDING: BINDING => ECO:0000250|UniProtKB:P35228
ChainResidueDetails
ACYS96
ACYS101
BCYS96
BCYS101

site_idSWS_FT_FI2
Number of Residues20
DetailsBINDING: BINDING => ECO:0000250|UniProtKB:P29474
ChainResidueDetails
ATRP358
ATYR359
AGLU363
AASN368
AALA448
ATRP449
APHE462
ATYR477
BSER104
BGLN249
BTRP358
BTYR359
BGLU363
BASN368
BALA448
BTRP449
BPHE462
BTYR477
ASER104
AGLN249

site_idSWS_FT_FI3
Number of Residues2
DetailsBINDING: axial binding residue => ECO:0000250|UniProtKB:P29474
ChainResidueDetails
ACYS186
BCYS186

site_idSWS_FT_FI4
Number of Residues2
DetailsMOD_RES: Phosphoserine; by CDK5 => ECO:0000250|UniProtKB:P29474
ChainResidueDetails
ASER116
BSER116

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PDB entries from 2024-05-15

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