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3N67

Structure of endothelial nitric oxide synthase N368D/V106M double mutant heme domain complexed with 6,6'-(2,2'-(5-amino-1,3-phenylene)bis(ethane-2,1-diyl))bis(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 Residues16
DetailsBINDING SITE FOR RESIDUE HEM A 500
ChainResidue
ATRP180
APHE475
ATYR477
AH4B600
AXFN800
AACT860
AHOH1018
AHOH1069
AARG185
ACYS186
ASER228
APHE355
ASER356
ATRP358
AGLU363
ATRP449

site_idAC2
Number of Residues8
DetailsBINDING SITE FOR RESIDUE ACT A 860
ChainResidue
AGLY188
ATRP358
AVAL420
ASER428
AHEM500
AHOH1088
AHOH1101
AHOH1126

site_idAC3
Number of Residues9
DetailsBINDING SITE FOR RESIDUE XFN A 800
ChainResidue
AGLN249
AVAL338
AASN340
AGLY357
ATRP358
AGLU363
ATYR477
AHEM500
AHOH1178

site_idAC4
Number of Residues5
DetailsBINDING SITE FOR RESIDUE CAD A 950
ChainResidue
ATHR85
ATRP324
ACYS384
AGLN437
AGLY441

site_idAC5
Number of Residues14
DetailsBINDING SITE FOR RESIDUE H4B A 600
ChainResidue
ASER104
AMET106
AARG367
AALA448
ATRP449
AHEM500
AHOH1015
AHOH1018
AHOH1034
AHOH1129
AHOH1171
BTRP447
BPHE462
BGLN464

site_idAC6
Number of Residues4
DetailsBINDING SITE FOR RESIDUE ZN A 900
ChainResidue
ACYS96
ACYS101
BCYS96
BCYS101

site_idAC7
Number of Residues15
DetailsBINDING SITE FOR RESIDUE HEM B 500
ChainResidue
BTRP180
BARG185
BCYS186
BSER228
BPHE355
BSER356
BTRP358
BGLU363
BTRP449
BTYR477
BH4B600
BXFN800
BHOH1202
BHOH1256
BHOH1276

site_idAC8
Number of Residues5
DetailsBINDING SITE FOR RESIDUE ACT B 860
ChainResidue
BTRP358
BVAL420
BSER428
BHOH1273
BHOH1351

site_idAC9
Number of Residues12
DetailsBINDING SITE FOR RESIDUE XFN B 800
ChainResidue
ATRP76
BMET106
BGLN249
BPRO336
BVAL338
BGLY357
BTRP358
BTYR359
BGLU363
BTYR477
BHEM500
BHOH1265

site_idBC1
Number of Residues3
DetailsBINDING SITE FOR RESIDUE CAD B 950
ChainResidue
BTYR83
BTRP324
BCYS384

site_idBC2
Number of Residues15
DetailsBINDING SITE FOR RESIDUE H4B B 600
ChainResidue
BHEM500
BHOH1202
BHOH1205
BHOH1243
BHOH1272
BHOH1301
BHOH1306
ATRP447
APHE462
AHIS463
AGLU465
BSER104
BARG367
BALA448
BTRP449

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 Residues18
DetailsBINDING: BINDING => ECO:0000250|UniProtKB:P29475
ChainResidueDetails
ASER104
BSER104
BGLN249
BTRP358
BTYR359
BGLU363
BALA448
BTRP449
BPHE462
BTYR477
AGLN249
ATRP358
ATYR359
AGLU363
AALA448
ATRP449
APHE462
ATYR477

site_idSWS_FT_FI2
Number of Residues2
DetailsBINDING: axial binding residue => ECO:0000250|UniProtKB:P29475
ChainResidueDetails
ACYS186
BCYS186

site_idSWS_FT_FI3
Number of Residues2
DetailsMOD_RES: Phosphoserine => ECO:0000250|UniProtKB:Q9Z0J4
ChainResidueDetails
ATHR46
BTHR46

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PDB entries from 2024-05-01

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