PDB entry 2vku

View 2vku on RCSB PDB site
Description: 4,4'-Dihydroxybenzophenone Mimics Sterol Substrate in the Binding Site of Sterol 14alpha-Demethylase (CYP51) in the X-ray Structure of the Complex
Class: oxidoreductase
Keywords: steroid biosynthesis, cyp51-4, cytoplasm, alpha-beta, heme co-factor, lipid synthesis, sterol biosynthesis, 4'-dihydroxybenzophenone complex, nadp, iron, heme, monooxygenase, metal-binding, oxidoreductase
Deposited on 2007-12-29, released 2008-03-25
The last revision prior to the SCOPe 2.08 freeze date was dated 2019-05-08, with a file datestamp of 2019-05-03.
Experiment type: XRAY
Resolution: 1.95 Å
R-factor: N/A
AEROSPACI score: 0.33 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: cytochrome p450 51
    Species: Mycobacterium tuberculosis [TaxId:83332]
    Database cross-references and differences (RAF-indexed):
    • Uniprot P0A512
      • engineered mutation (36)
      • engineered mutation (441)
    • PDB 2VKU
    Domains in SCOPe 2.08: d2vkua_
  • Heterogens: DBE, HEM, SO4, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >2vkuA (A:)
msavalprvsgghdehghleefrtdpiglmqrvrdelgdvgtfqlagkqvvllsgshane
fffragdddldqakaypfmtpifgegvvfdasperrkemlhnaalrgeqmkghaatiedq
vrrmiadwgeageidlldffaeltiytssacligkkfrdqldgrfaklyhelergtdpla
yvdpylpiesfrrrdearnglvalvadimngrianpptdksdrdmldvliavkaetgtpr
fsadeitgmfismmfaghhtssgtaswtlielmrhrdayaavideldelygdgrsvsfha
lrqipqlenvlketlrlhppliilmrvakgefevqghrihegdlvaaspaisnripedfp
dphdfvparyeqprqedllnrwtwipfgagrhrcvgaafaimqikaifsvllreyefema
qppesyrndhskmvvqlaqpaavryrrrtgvhhhh

    Sequence, based on observed residues (ATOM records): (download) 
    >2vkuA (A:)
lprvsgghdehghleefrtdpiglmqrvrdelgdvgtfqlagkqvvllsgshanefffra
gdddldqakaypfmtpifgegvvfdasperrkemlhnaalrgeqmkghaatiedqvrrmi
adwgeageidlldffaeltiytssacligkkfrdqldgrfaklyhelergtdplayvdpy
lpiesfrrrdearnglvalvadimngrianpptdksdrdmldvliavkaetgtprfsade
itgmfismmfaghhtssgtaswtlielmrhrdayaavideldelygdgrsvsfhalrqip
qlenvlketlrlhppliilmrvakgefevqghrihegdlvaaspaisnripedfpdphdf
vparyeqprqedllnrwtwipfgagrhrcvgaafaimqikaifsvllreyefemaqppes
yrndhskmvvqlaqpaavryrrrtg