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4CWY

Structure of bovine endothelial nitric oxide synthase heme domain in complex with 6-(5-(((3R,4R)-4-((6-AMINO-4-METHYLPYRIDIN-2-YL)METHYL) PYRROLIDIN-3-YL)OXY)PENTYL)-4-METHYLPYRIDIN-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
AH4B600
AHW1800
AHOH2110
AHOH2157
AHOH2158
AHOH2159
ACYS186
ASER228
APHE355
ASER356
ATRP358
AGLU363
ATRP449
ATYR477

site_idAC2
Number of Residues16
DetailsBINDING SITE FOR RESIDUE H4B A 600
ChainResidue
ASER104
AVAL106
AARG367
AALA448
ATRP449
AHEM500
AHW1800
AHOH2114
AHOH2116
AHOH2141
AHOH2159
BTRP447
BPHE462
BHIS463
BGLN464
BGLU465

site_idAC3
Number of Residues12
DetailsBINDING SITE FOR RESIDUE HW1 A 800
ChainResidue
AASN340
AMET341
APHE355
AGLY357
ATRP358
ATYR359
AGLU363
ATRP449
ATYR477
AHEM500
AH4B600
AHOH2159

site_idAC4
Number of Residues5
DetailsBINDING SITE FOR RESIDUE ACT A 860
ChainResidue
AGLY188
ATRP358
AVAL420
ASER428
AHOH2050

site_idAC5
Number of Residues5
DetailsBINDING SITE FOR RESIDUE ACT A 861
ChainResidue
AGLN249
AARG252
AASN368
AARG374
AHOH2079

site_idAC6
Number of Residues17
DetailsBINDING SITE FOR RESIDUE HEM B 500
ChainResidue
BTRP180
BARG185
BCYS186
BSER228
BPHE355
BSER356
BTRP358
BMET360
BGLU363
BPHE475
BTYR477
BH4B600
BHW1800
BHOH2098
BHOH2128
BHOH2129
BHOH2130

site_idAC7
Number of Residues15
DetailsBINDING SITE FOR RESIDUE H4B B 600
ChainResidue
ATRP447
APHE462
AHIS463
AGLU465
AHOH2149
BSER104
BVAL106
BARG367
BALA448
BTRP449
BHEM500
BHW1800
BHOH2102
BHOH2120
BHOH2129

site_idAC8
Number of Residues13
DetailsBINDING SITE FOR RESIDUE HW1 B 800
ChainResidue
BLEU107
BASN340
BMET341
BPHE355
BGLY357
BTRP358
BGLU363
BTRP449
BTYR477
BHEM500
BH4B600
BHOH2091
BHOH2129

site_idAC9
Number of Residues7
DetailsBINDING SITE FOR RESIDUE ACT B 860
ChainResidue
BGLN191
BTRP358
BVAL420
BSER428
BHOH2033
BHOH2131
BGLY188

site_idBC1
Number of Residues5
DetailsBINDING SITE FOR RESIDUE ACT B 861
ChainResidue
BGLN249
BARG252
BASN368
BARG374
BHOH2069

site_idBC2
Number of Residues4
DetailsBINDING SITE FOR RESIDUE ZN B 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
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

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PDB entries from 2024-06-19

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