3CV6

The crystal structure of mouse 17-alpha hydroxysteroid dehydrogenase GG225.226PP mutant in complex with inhibitor and cofactor NADP+.

Summary for 3CV6

DescriptorAldo-keto reductase family 1 member C21, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, 4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenol, ... (5 entities in total)
Functional Keywordsaldo-keto reductase, hydroxysteroid dehydrogenase, ternary complex, hexestrol, lipid metabolism, nadp, oxidoreductase, phosphoprotein, steroid metabolism
Biological sourceMus musculus (Mouse)
Cellular locationCytoplasm (By similarity) Q91WR5
Total number of polymer chains2
Total molecular weight76427.62
Authors
Dhagat, U.,El-Kabbani, O. (deposition date: 2008-04-17, release date: 2009-03-03, Last modification date: 2012-04-18)
Primary citation
Dhagat, U.,Endo, S.,Mamiya, H.,Hara, A.,El-Kabbani, O.
Structure of the G225P/G226P mutant of mouse 3(17)alpha-hydroxysteroid dehydrogenase (AKR1C21) ternary complex: implications for the binding of inhibitor and substrate.
Acta Crystallogr.,Sect.D, 65:257-265, 2009
PubMed: 19237748 (PDB entries with the same primary citation)
DOI: 10.1107/S0907444908044028
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (2.1 Å)
?

Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers0.251110.2%1.7%0MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution

More Asymmetric unit images

Molmil generated image of 3cv6
no rotation
Molmil generated image of 3cv6
rotated about x axis by 90°
Molmil generated image of 3cv6
rotated about y axis by 90°

More Biological unit images

Molmil generated image of 3cv6
no rotation
Molmil generated image of 3cv6
rotated about x axis by 90°
Molmil generated image of 3cv6
rotated about y axis by 90°
(*)In the case of coarse surface representation, the asymmetric unit is shown as red ribbon representation.
Coordinate files for Biological unit (3cv6.pdb2.gz [63.36 KB])
Coordinate files for Biological unit (3cv6.pdb1.gz [63.52 KB])