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5FVY

Structure of bovine endothelial nitric oxide synthase heme domain in complex with 4-methyl-6-(2-(5-(4-methylpiperazin-1-yl)pyridin-3-yl) ethyl)pyridin-2-amine

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 Residues15
DetailsBINDING SITE FOR RESIDUE HEM A 500
ChainResidue
ATRP180
APHE475
ATYR477
AH4B600
AW64800
AHOH2205
AHOH2206
AARG185
ACYS186
ASER228
APHE355
ASER356
ATRP358
AGLU363
ATRP449

site_idAC2
Number of Residues15
DetailsBINDING SITE FOR RESIDUE H4B A 600
ChainResidue
ASER104
AARG367
AALA448
ATRP449
AHEM500
AGOL880
AHOH2026
AHOH2151
AHOH2188
AHOH2206
BTRP447
BPHE462
BHIS463
BGLN464
BGLU465

site_idAC3
Number of Residues13
DetailsBINDING SITE FOR RESIDUE W64 A 800
ChainResidue
APRO336
AVAL338
AASN340
AMET341
APHE355
AGLY357
ATRP358
AGLU363
ATYR477
AHEM500
AACT861
AEDO870
AHOH2206

site_idAC4
Number of Residues5
DetailsBINDING SITE FOR RESIDUE ACT A 860
ChainResidue
AGLY188
ATRP358
AVAL420
ASER428
AHOH2066

site_idAC5
Number of Residues5
DetailsBINDING SITE FOR RESIDUE ACT A 861
ChainResidue
AARG252
AASN368
AARG374
AW64800
AEDO870

site_idAC6
Number of Residues8
DetailsBINDING SITE FOR RESIDUE EDO A 870
ChainResidue
AGLN249
ATYR333
ATYR359
AGLU363
AASN368
AW64800
AACT861
AHOH2147

site_idAC7
Number of Residues5
DetailsBINDING SITE FOR RESIDUE GOL A 880
ChainResidue
AARG367
AHIS373
AH4B600
AHOH2151
AHOH2206

site_idAC8
Number of Residues17
DetailsBINDING SITE FOR RESIDUE HEM B 500
ChainResidue
BTRP180
BCYS186
BSER228
BPHE355
BSER356
BTRP358
BMET360
BGLU363
BTRP449
BPHE475
BTYR477
BH4B600
BW64800
BEDO870
BHOH2141
BHOH2143
BHOH2144

site_idAC9
Number of Residues12
DetailsBINDING SITE FOR RESIDUE H4B B 600
ChainResidue
ATRP447
APHE462
AGLN464
AGLU465
BSER104
BARG367
BALA448
BTRP449
BHEM500
BGOL880
BHOH2133
BHOH2144

site_idBC1
Number of Residues14
DetailsBINDING SITE FOR RESIDUE W64 B 800
ChainResidue
BGLY357
BTRP358
BTYR359
BGLU363
BTYR477
BHEM500
BACT861
BEDO870
BHOH2051
BHOH2144
BVAL338
BASN340
BMET341
BPHE355

site_idBC2
Number of Residues5
DetailsBINDING SITE FOR RESIDUE ACT B 860
ChainResidue
BTRP358
BVAL420
BSER428
BHOH2050
BHOH2145

site_idBC3
Number of Residues5
DetailsBINDING SITE FOR RESIDUE ACT B 861
ChainResidue
BARG252
BASN368
BARG374
BW64800
BEDO870

site_idBC4
Number of Residues10
DetailsBINDING SITE FOR RESIDUE EDO B 870
ChainResidue
BGLN249
BARG252
BTYR333
BTYR359
BGLU363
BASN368
BHEM500
BW64800
BACT861
BHOH2107

site_idBC5
Number of Residues6
DetailsBINDING SITE FOR RESIDUE GOL B 880
ChainResidue
AHOH2193
BVAL106
BARG367
BHIS373
BTRP449
BH4B600

site_idBC6
Number of Residues4
DetailsBINDING SITE FOR RESIDUE ZN A 900
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
ASER104
ATYR477
BSER104
BGLN249
BTRP358
BTYR359
BGLU363
BASN368
BALA448
BTRP449
BPHE462
AGLN249
BTYR477
ATRP358
ATYR359
AGLU363
AASN368
AALA448
ATRP449
APHE462

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

229183

PDB entries from 2024-12-18

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