Ternary complex crystal structure of secondary alcohol dehydrogenases from the Thermoanaerobacter ethanolicus mutants C295 and I86A provides better understanding of catalytic mechanism

PDB ID: 7JNS
Gene source organism: Thermoanaerobacter ethanolicus
Expression organism: Escherichia coli Deposition date: 2020-08-05
Classification: OXIDOREDUCTASE
Keywords: secondary alcohol dehydrogenases, NADP, 3-methylcyclohexanol, OXIDOREDUCTASE
Technique: X-RAY DIFFRACTION
Assembly: 1
Resolution: 2.34
R-value: 0.1776
Metal site idBound amino acidsBound ligands IDs
7JNS-K-1 G1H1T1Y1 GLY A.259 HIS A.287 THR A.289 TYR B.99
7JNS-K-2 G1H1T1Y1 GLY B.259 HIS B.287 HOH B.548 THR B.289 TYR A.99
7JNS-K-3 G1H1T1Y1 GLY C.259 HIS C.287 HOH C.546 THR C.289 TYR D.99
7JNS-K-4 G1H1T1Y1 GLY D.259 HIS D.287 HOH D.547 THR D.289 TYR C.99