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5UAP

Crystal Structure of CYP2B6 (Y226H/K262R) in complex with Bornyl Bromide

Functional Information from GO Data
ChainGOidnamespacecontents
A0004497molecular_functionmonooxygenase activity
A0005506molecular_functioniron ion binding
A0005737cellular_componentcytoplasm
A0005783cellular_componentendoplasmic reticulum
A0005789cellular_componentendoplasmic reticulum membrane
A0006629biological_processlipid metabolic process
A0006805biological_processxenobiotic metabolic process
A0008202biological_processsteroid metabolic process
A0008390molecular_functiontestosterone 16-alpha-hydroxylase activity
A0008392molecular_functionarachidonic acid epoxygenase activity
A0016020cellular_componentmembrane
A0016705molecular_functionoxidoreductase activity, acting on paired donors, with incorporation or reduction of molecular oxygen
A0016712molecular_functionoxidoreductase activity, acting on paired donors, with incorporation or reduction of molecular oxygen, reduced flavin or flavoprotein as one donor, and incorporation of one atom of oxygen
A0019373biological_processepoxygenase P450 pathway
A0020037molecular_functionheme binding
A0042178biological_processxenobiotic catabolic process
A0042180biological_processcellular ketone metabolic process
A0043231cellular_componentintracellular membrane-bounded organelle
A0046872molecular_functionmetal ion binding
A0062184molecular_functiontestosterone 16-beta-hydroxylase activity
A0062187molecular_functionanandamide 8,9 epoxidase activity
A0062188molecular_functionanandamide 11,12 epoxidase activity
A0062189molecular_functionanandamide 14,15 epoxidase activity
A0101021molecular_functionestrogen 2-hydroxylase activity
B0004497molecular_functionmonooxygenase activity
B0005506molecular_functioniron ion binding
B0005737cellular_componentcytoplasm
B0005783cellular_componentendoplasmic reticulum
B0005789cellular_componentendoplasmic reticulum membrane
B0006629biological_processlipid metabolic process
B0006805biological_processxenobiotic metabolic process
B0008202biological_processsteroid metabolic process
B0008390molecular_functiontestosterone 16-alpha-hydroxylase activity
B0008392molecular_functionarachidonic acid epoxygenase activity
B0016020cellular_componentmembrane
B0016705molecular_functionoxidoreductase activity, acting on paired donors, with incorporation or reduction of molecular oxygen
B0016712molecular_functionoxidoreductase activity, acting on paired donors, with incorporation or reduction of molecular oxygen, reduced flavin or flavoprotein as one donor, and incorporation of one atom of oxygen
B0019373biological_processepoxygenase P450 pathway
B0020037molecular_functionheme binding
B0042178biological_processxenobiotic catabolic process
B0042180biological_processcellular ketone metabolic process
B0043231cellular_componentintracellular membrane-bounded organelle
B0046872molecular_functionmetal ion binding
B0062184molecular_functiontestosterone 16-beta-hydroxylase activity
B0062187molecular_functionanandamide 8,9 epoxidase activity
B0062188molecular_functionanandamide 11,12 epoxidase activity
B0062189molecular_functionanandamide 14,15 epoxidase activity
B0101021molecular_functionestrogen 2-hydroxylase activity
Functional Information from PDB Data
site_idAC1
Number of Residues23
Detailsbinding site for residue HEM A 501
ChainResidue
AARG98
AGLN357
ALEU362
AVAL367
AHIS369
APRO428
APHE429
ASER430
AARG434
ACYS436
ALEU437
AVAL113
AGLY438
AALA442
AHOH847
AHOH872
ATRP121
AARG125
AILE179
AALA298
AGLY299
ATHR302
ATHR306

site_idAC2
Number of Residues8
Detailsbinding site for residue CM5 A 503
ChainResidue
APHE188
AGLU194
AMET198
APHE202
ATYR244
APHE296
AHOH604
BLYS384

site_idAC3
Number of Residues4
Detailsbinding site for residue CM5 A 504
ChainResidue
AMET46
AASP47
AARG48
AHOH704

site_idAC4
Number of Residues7
Detailsbinding site for residue 82S A 505
ChainResidue
AILE114
APHE115
APHE206
APHE297
AALA298
ALEU363
AHOH872

site_idAC5
Number of Residues22
Detailsbinding site for residue HEM B 501
ChainResidue
BARG98
BVAL113
BTRP121
BARG125
BLEU295
BALA298
BGLY299
BTHR302
BTHR306
BGLN357
BLEU362
BVAL367
BHIS369
BPRO428
BPHE429
BSER430
BARG434
BCYS436
BLEU437
BGLY438
BHOH811
BHOH839

site_idAC6
Number of Residues1
Detailsbinding site for residue CM5 B 502
ChainResidue
BPHE223

site_idAC7
Number of Residues9
Detailsbinding site for residue CM5 B 503
ChainResidue
ALYS384
BPHE188
BGLU194
BPHE195
BMET198
BALA243
BTYR244
BPHE296
BHOH756

site_idAC8
Number of Residues3
Detailsbinding site for residue CM5 B 504
ChainResidue
BLEU43
BARG48
BHOH826

site_idAC9
Number of Residues8
Detailsbinding site for residue 82S B 505
ChainResidue
BILE114
BPHE115
BPHE206
BPHE297
BALA298
BTHR302
BLEU363
BHOH839

Functional Information from PROSITE/UniProt
site_idPS00086
Number of Residues10
DetailsCYTOCHROME_P450 Cytochrome P450 cysteine heme-iron ligand signature. FSlGKRICLG
ChainResidueDetails
APHE429-GLY438

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues2
DetailsBINDING: axial binding residue
ChainResidueDetails
ACYS436
BCYS436

site_idSWS_FT_FI2
Number of Residues2
DetailsMOD_RES: Phosphoserine; by PKA => ECO:0000250
ChainResidueDetails
ASER128
BSER128

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PDB entries from 2024-07-17

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