6MA8

Human CYP3A4 bound to PMSF

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Functional Information from GO Data

ChainGOidnamespacecontents
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Functional Information from PDB Data

site_idNumber of ResiduesDetails
AC121binding site for residue HEM A 601
ChainResidue
AARG105
AILE118
ASER119
ATRP126
AARG130
APHE137
AALA305
AGLY306
AALA370
AARG375
APRO434
APHE435
AGLY436
ASER437
AARG440
AASN441
ACYS442
AILE443
APMF604
AHOH758
AHOH829

AC210binding site for residue GOL A 602
ChainResidue
ALYS55
AGLY56
APHE57
ACYS58
AMET59
AMET371
ASER478
AGLY480
AGLY481
ALEU482

AC35binding site for residue GOL A 603
ChainResidue
ASER52
AGLU63
ACYS64
ALYS67
ATYR68

AC48binding site for residue PMF A 604
ChainResidue
AARG105
ASER119
AARG212
AILE301
APHE304
AALA305
AHEM601
AHOH780

AC54binding site for residue EDO A 605
ChainResidue
ALYS209
ALEU211
APHE213
APRO242

AC63binding site for residue EDO A 606
ChainResidue
AASP217
AVAL240
ADMS612

AC73binding site for residue EDO A 607
ChainResidue
ALYS34
AASP326
ALYS330

AC84binding site for residue EDO A 608
ChainResidue
AGLU308
ASER312
ALEU483
AHOH712

AC94binding site for residue EDO A 609
ChainResidue
ALYS173
AGLY177
AGLU308
ASER311

AD13binding site for residue EDO A 610
ChainResidue
AVAL155
AARG158
AASP194

AD21binding site for residue EDO A 611
ChainResidue
ALYS330

AD32binding site for residue DMS A 612
ChainResidue
APHE219
AEDO606

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Functional Information from PDB atom coordinates for the "HETATM" binding sites

site_idNumber of ResiduesDetails
EDO_6ma8_A_60711,2-ETHANEDIOL binding site
ChainResidueligand
ALYS34EDO: 1,2-ETHANEDIOL

GOL_6ma8_A_6037GLYCEROL binding site
ChainResidueligand
APRO41GOL: GLYCEROL
ASER52GOL: GLYCEROL
APHE60GOL: GLYCEROL
AGLU63-CYS64GOL: GLYCEROL
ALYS67-TYR68GOL: GLYCEROL

GOL_6ma8_A_60214GLYCEROL binding site
ChainResidueligand
ALYS55-MET59GOL: GLYCEROL
ALEU216GOL: GLYCEROL
AMET371GOL: GLYCEROL
ALEU477-LEU483GOL: GLYCEROL

HEM_6ma8_A_60133PROTOPORPHYRIN IX CONTAINING FE binding site
ChainResidueligand
ALEU94HEM: PROTOPORPHYRIN IX CONTAINING FE
AARG105HEM: PROTOPORPHYRIN IX CONTAINING FE
AILE118-SER119HEM: PROTOPORPHYRIN IX CONTAINING FE
ATRP126HEM: PROTOPORPHYRIN IX CONTAINING FE
AARG130HEM: PROTOPORPHYRIN IX CONTAINING FE
APHE137HEM: PROTOPORPHYRIN IX CONTAINING FE
APHE271HEM: PROTOPORPHYRIN IX CONTAINING FE
AILE301-PHE302HEM: PROTOPORPHYRIN IX CONTAINING FE
AALA305-GLY306HEM: PROTOPORPHYRIN IX CONTAINING FE
ATHR309-THR310HEM: PROTOPORPHYRIN IX CONTAINING FE
AVAL313HEM: PROTOPORPHYRIN IX CONTAINING FE
ALEU364HEM: PROTOPORPHYRIN IX CONTAINING FE
AILE369-ALA370HEM: PROTOPORPHYRIN IX CONTAINING FE
ALEU373HEM: PROTOPORPHYRIN IX CONTAINING FE
AARG375HEM: PROTOPORPHYRIN IX CONTAINING FE
ATHR433-SER437HEM: PROTOPORPHYRIN IX CONTAINING FE
AARG440-GLY444HEM: PROTOPORPHYRIN IX CONTAINING FE
APHE447-ALA448HEM: PROTOPORPHYRIN IX CONTAINING FE
AMET452HEM: PROTOPORPHYRIN IX CONTAINING FE

PMF_6ma8_A_6047PHENYLMETHYLSULFONYL FLUORIDE binding site
ChainResidueligand
AARG105PMF: PHENYLMETHYLSULFONYL FLUORIDE
ASER119PMF: PHENYLMETHYLSULFONYL FLUORIDE
AARG212PMF: PHENYLMETHYLSULFONYL FLUORIDE
AILE301PMF: PHENYLMETHYLSULFONYL FLUORIDE
APHE304-ALA305PMF: PHENYLMETHYLSULFONYL FLUORIDE
AALA370PMF: PHENYLMETHYLSULFONYL FLUORIDE

EDO_6ma8_A_61041,2-ETHANEDIOL binding site
ChainResidueligand
AVAL155EDO: 1,2-ETHANEDIOL
AARG158-ASN159EDO: 1,2-ETHANEDIOL
AASP194EDO: 1,2-ETHANEDIOL

EDO_6ma8_A_60971,2-ETHANEDIOL binding site
ChainResidueligand
ALYS173-ASP174EDO: 1,2-ETHANEDIOL
AGLY177EDO: 1,2-ETHANEDIOL
ALEU211EDO: 1,2-ETHANEDIOL
ATYR307-GLU308EDO: 1,2-ETHANEDIOL
ASER311EDO: 1,2-ETHANEDIOL

EDO_6ma8_A_60591,2-ETHANEDIOL binding site
ChainResidueligand
ALYS209-PHE213EDO: 1,2-ETHANEDIOL
AVAL240-PRO242EDO: 1,2-ETHANEDIOL
APHE304EDO: 1,2-ETHANEDIOL

EDO_6ma8_A_60881,2-ETHANEDIOL binding site
ChainResidueligand
AARG212EDO: 1,2-ETHANEDIOL
AGLU308-THR309EDO: 1,2-ETHANEDIOL
ASER312EDO: 1,2-ETHANEDIOL
AILE369EDO: 1,2-ETHANEDIOL
ALEU482-GLN484EDO: 1,2-ETHANEDIOL

EDO_6ma8_A_60651,2-ETHANEDIOL binding site
ChainResidueligand
APHE213EDO: 1,2-ETHANEDIOL
AASP217EDO: 1,2-ETHANEDIOL
APHE219-PHE220EDO: 1,2-ETHANEDIOL
AVAL240EDO: 1,2-ETHANEDIOL

DMS_6ma8_A_6124DIMETHYL SULFOXIDE binding site
ChainResidueligand
APHE219DMS: DIMETHYL SULFOXIDE
AILE238-VAL240DMS: DIMETHYL SULFOXIDE

EDO_6ma8_A_61171,2-ETHANEDIOL binding site
ChainResidueligand
ALYS330EDO: 1,2-ETHANEDIOL
AGLU334EDO: 1,2-ETHANEDIOL
AGLU354-TYR355EDO: 1,2-ETHANEDIOL
AMET358EDO: 1,2-ETHANEDIOL
AGLU417EDO: 1,2-ETHANEDIOL
ASER420EDO: 1,2-ETHANEDIOL

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Functional Information from PROSITE/UniProt

site_idNumber of ResiduesDetails
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Functional Information from SwissProt/UniProt

site_idNumber of ResiduesDetails
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Catalytic Information from CSA

site_idNumber of ResiduesDetails