Loading
PDBj
MenuPDBj@FacebookPDBj@TwitterPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help

3R9C

Crystal structure of Mycobacterium smegmatis CYP164A2 with Econazole bound

Functional Information from GO Data
ChainGOidnamespacecontents
A0004497molecular_functionmonooxygenase activity
A0005506molecular_functioniron ion binding
A0006707biological_processcholesterol catabolic process
A0008395molecular_functionsteroid hydroxylase activity
A0016705molecular_functionoxidoreductase activity, acting on paired donors, with incorporation or reduction of molecular oxygen
A0020037molecular_functionheme binding
A0036199molecular_functioncholest-4-en-3-one 26-monooxygenase activity
A0046872molecular_functionmetal ion binding
Functional Information from PDB Data
site_idAC1
Number of Residues23
DetailsBINDING SITE FOR RESIDUE HEM A 450
ChainResidue
AHIS105
AMET297
AVAL303
AARG308
AGLY358
APHE359
AGLY360
AALA363
AHIS364
ACYS366
AGLY368
AARG109
AALA372
ANA425
AHOH442
AECL451
APHE116
AILE159
ALEU252
ALEU253
AALA256
ATHR260
ALEU264

site_idAC2
Number of Residues11
DetailsBINDING SITE FOR RESIDUE ECL A 451
ChainResidue
AALA95
ALEU184
AILE255
AALA256
ATHR260
AVAL303
ALEU305
AVAL306
ATHR403
AHEM450
AECL452

site_idAC3
Number of Residues12
DetailsBINDING SITE FOR RESIDUE ECL A 452
ChainResidue
ASER71
APRO94
AALA95
ALEU98
ALEU100
AVAL112
AALA248
ATHR249
AASN251
ALEU367
ANA425
AECL451

site_idAC4
Number of Residues2
DetailsBINDING SITE FOR RESIDUE EDO A 419
ChainResidue
AARG288
AASP350

site_idAC5
Number of Residues3
DetailsBINDING SITE FOR RESIDUE EDO A 420
ChainResidue
APRO89
AILE354
AARG355

site_idAC6
Number of Residues5
DetailsBINDING SITE FOR RESIDUE EDO A 421
ChainResidue
ALEU64
AHIS66
ASER69
AHIS364
AGLU397

site_idAC7
Number of Residues3
DetailsBINDING SITE FOR RESIDUE EDO A 422
ChainResidue
AGLY224
AGLU225
AASP226

site_idAC8
Number of Residues2
DetailsBINDING SITE FOR RESIDUE EDO A 423
ChainResidue
APRO47
AASN50

site_idAC9
Number of Residues4
DetailsBINDING SITE FOR RESIDUE EDO A 424
ChainResidue
AGLU143
APHE144
AASN145
ASER411

site_idBC1
Number of Residues4
DetailsBINDING SITE FOR RESIDUE NA A 425
ChainResidue
AHIS105
AHIS364
AHEM450
AECL452

Functional Information from PROSITE/UniProt
site_idPS00086
Number of Residues10
DetailsCYTOCHROME_P450 Cytochrome P450 cysteine heme-iron ligand signature. FGkGAHFCLG
ChainResidueDetails
APHE359-GLY368

221051

PDB entries from 2024-06-12

PDB statisticsPDBj update infoContact PDBjnumon