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4KTJ

Crystal structure of Mycobacterium tuberculosis CYP121 in complex with 4-(3-amino-1H-pyrazol-4-yl)phenol

Functional Information from GO Data
ChainGOidnamespacecontents
A0004497molecular_functionmonooxygenase activity
A0005506molecular_functioniron ion binding
A0016705molecular_functionoxidoreductase activity, acting on paired donors, with incorporation or reduction of molecular oxygen
A0020037molecular_functionheme binding
Functional Information from PDB Data
site_idAC1
Number of Residues23
DetailsBINDING SITE FOR RESIDUE HEM A 401
ChainResidue
AMET62
AARG286
AALA337
APHE338
AGLY339
AHIS343
ACYS345
APRO346
ASO4402
AHOH509
AHOH514
AMET86
AHOH516
AHOH563
AHOH656
AHOH776
AHIS146
APHE230
AGLY234
ASER237
APHE241
APHE280
ALEU284

site_idAC2
Number of Residues6
DetailsBINDING SITE FOR RESIDUE SO4 A 402
ChainResidue
APHE168
AALA233
AARG386
AHEM401
AHOH508
AHOH514

site_idAC3
Number of Residues8
DetailsBINDING SITE FOR RESIDUE SO4 A 403
ChainResidue
AARG58
ASER61
AMET62
ALYS63
AHIS343
AHOH706
AHOH729
AHOH984

site_idAC4
Number of Residues8
DetailsBINDING SITE FOR RESIDUE KTJ A 404
ChainResidue
AVAL78
AASN85
AVAL228
ATHR229
AHOH501
AHOH506
AHOH515
AHOH535

Functional Information from PROSITE/UniProt
site_idPS00086
Number of Residues10
DetailsCYTOCHROME_P450 Cytochrome P450 cysteine heme-iron ligand signature. FGrGQHFCPG
ChainResidueDetails
APHE338-GLY347

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PDB entries from 2024-10-16

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