PDB entry 3qwh

View 3qwh on RCSB PDB site
Description: Crystal structure of the 17beta-hydroxysteroid dehydrogenase from Cochliobolus lunatus in complex with NADPH and kaempferol
Class: oxidoreductase/oxidoreductase inhibitor
Keywords: 17BETA-HYDROXYSTEROID DEHYDROGENASE, SHORT CHAIN DEHYDROGENASE/REDUCTASE, PHYTOESTROGENS, FLAVONOIDS, Rossmann Fold, Cytosol, OXIDOREDUCTASE-OXIDOREDUCTASE INHIBITOR complex
Deposited on 2011-02-28, released 2012-03-21
The last revision prior to the SCOPe 2.08 freeze date was dated 2017-11-08, with a file datestamp of 2017-11-03.
Experiment type: XRAY
Resolution: 2.62 Å
R-factor: N/A
AEROSPACI score: 0.19 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: 17beta-hydroxysteroid dehydrogenase
    Species: Cochliobolus lunatus [TaxId:5503]
    Gene: 17HSDcl
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d3qwha_
  • Chain 'B':
    Compound: 17beta-hydroxysteroid dehydrogenase
    Species: Cochliobolus lunatus [TaxId:5503]
    Gene: 17HSDcl
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d3qwhb_
  • Chain 'C':
    Compound: 17beta-hydroxysteroid dehydrogenase
    Species: Cochliobolus lunatus [TaxId:5503]
    Gene: 17HSDcl
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d3qwhc_
  • Chain 'D':
    Compound: 17beta-hydroxysteroid dehydrogenase
    Species: Cochliobolus lunatus [TaxId:5503]
    Gene: 17HSDcl
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d3qwhd_
  • Heterogens: NAP, KMP, PEG, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >3qwhA (A:)
mphvenasetyipgrldgkvalvtgsgrgigaavavhlgrlgakvvvnyanstkdaekvv
seikalgsdaiaikadirqvpeivklfdqavahfghldiavsnsgvvsfghlkdvteeef
drvfslntrgqffvareayrhlteggrivltssntskdfsvpkhslysgskgavdsfvri
fskdcgdkkitvnavapggtvtdmfhevshhyipngtsytaeqrqqmaahasplhrngwp
qdvanvvgflvskegewvngkvltldggaa

    Sequence, based on observed residues (ATOM records): (download) 
    >3qwhA (A:)
yipgrldgkvalvtgsgrgigaavavhlgrlgakvvvnyanstkdaekvvseikalgsda
iaikadirqvpeivklfdqavahfghldiavsnsgvvsfghlkdvteeefdrvfslntrg
qffvareayrhlteggrivltssntskdfsvpkhslysgskgavdsfvrifskdcgdkki
tvnavapggtvtdmfhevshhyipngtsytaeqrqqmaahasplhrngwpqdvanvvgfl
vskegewvngkvltldggaa

  • Chain 'B':
    Sequence, based on SEQRES records: (download) 
    >3qwhB (B:)
mphvenasetyipgrldgkvalvtgsgrgigaavavhlgrlgakvvvnyanstkdaekvv
seikalgsdaiaikadirqvpeivklfdqavahfghldiavsnsgvvsfghlkdvteeef
drvfslntrgqffvareayrhlteggrivltssntskdfsvpkhslysgskgavdsfvri
fskdcgdkkitvnavapggtvtdmfhevshhyipngtsytaeqrqqmaahasplhrngwp
qdvanvvgflvskegewvngkvltldggaa

    Sequence, based on observed residues (ATOM records): (download) 
    >3qwhB (B:)
tyipgrldgkvalvtgsgrgigaavavhlgrlgakvvvnyanstkdaekvvseikalgsd
aiaikadirqvpeivklfdqavahfghldiavsnsgvvsfghlkdvteeefdrvfslntr
gqffvareayrhlteggrivltssntskdfsvpkhslysgskgavdsfvrifskdcgdkk
itvnavapggtvtdmfhevshhyipngtsytaeqrqqmaahasplhrngwpqdvanvvgf
lvskegewvngkvltldggaa

  • Chain 'C':
    Sequence, based on SEQRES records: (download) 
    >3qwhC (C:)
mphvenasetyipgrldgkvalvtgsgrgigaavavhlgrlgakvvvnyanstkdaekvv
seikalgsdaiaikadirqvpeivklfdqavahfghldiavsnsgvvsfghlkdvteeef
drvfslntrgqffvareayrhlteggrivltssntskdfsvpkhslysgskgavdsfvri
fskdcgdkkitvnavapggtvtdmfhevshhyipngtsytaeqrqqmaahasplhrngwp
qdvanvvgflvskegewvngkvltldggaa

    Sequence, based on observed residues (ATOM records): (download) 
    >3qwhC (C:)
grldgkvalvtgsgrgigaavavhlgrlgakvvvnyanstkdaekvvseikalgsdaiai
kadirqvpeivklfdqavahfghldiavsnsgvvsfghlkdvteeefdrvfslntrgqff
vareayrhlteggrivltssntskdfsvpkhslysgskgavdsfvrifskdcgdkkitvn
avapggtvtdmfhevshhyipngtsytaeqrqqmaahasplhrngwpqdvanvvgflvsk
egewvngkvltldggaa

  • Chain 'D':
    Sequence, based on SEQRES records: (download) 
    >3qwhD (D:)
mphvenasetyipgrldgkvalvtgsgrgigaavavhlgrlgakvvvnyanstkdaekvv
seikalgsdaiaikadirqvpeivklfdqavahfghldiavsnsgvvsfghlkdvteeef
drvfslntrgqffvareayrhlteggrivltssntskdfsvpkhslysgskgavdsfvri
fskdcgdkkitvnavapggtvtdmfhevshhyipngtsytaeqrqqmaahasplhrngwp
qdvanvvgflvskegewvngkvltldggaa

    Sequence, based on observed residues (ATOM records): (download) 
    >3qwhD (D:)
tyipgrldgkvalvtgsgrgigaavavhlgrlgakvvvnyanstkdaekvvseikalgsd
aiaikadirqvpeivklfdqavahfghldiavsnsgvvsfghlkdvteeefdrvfslntr
gqffvareayrhlteggrivltssntskdfsvpkhslysgskgavdsfvrifskdcgdkk
itvnavapggtvtdmfhevshhyipngtsytaeqrqqmaahasplhrngwpqdvanvvgf
lvskegewvngkvltldggaa