Crystal Structure of the Covalent Thioimide Intermediate of Unimodular Nitrile Reductase QueF

PDB ID: 4F8B
Gene source organism: Bacillus subtilis subsp. subtilis
Expression organism: Escherichia coli Deposition date: 2012-05-17
Classification: OXIDOREDUCTASE
Keywords: beta barrel, protein thioimide complex, pterin binding fold, tunnel fold, tRNA modification enzyme, 7-cyano-7-deazaguanine, NADPH, OXIDOREDUCTASE
Technique: X-RAY DIFFRACTION
Assembly: 1
Resolution: 2.502
R-value: 0.18918
Metal site idBound amino acidsBound ligands IDs
4F8B-MG-1 D1R2 ARG B.164 ARG E.164 ASP B.162 HOH B.301 HOH B.302 HOH E.301
4F8B-MG-2 D1R2 ARG B.164 ARG E.164 ASP B.162 HOH B.301 HOH B.302 HOH E.301
4F8B-MG-3 D1R2 ARG C.164 ARG D.164 ASP C.162 HOH C.301 HOH C.302 HOH D.302
4F8B-MG-4 D1R2 ARG C.164 ARG D.164 ASP C.162 HOH C.301 HOH C.302 HOH D.302
4F8B-MG-5 D1R2 ARG C.164 ARG D.164 ASP D.162 HOH D.301 HOH D.302 HOH D.303
4F8B-MG-6 D1R2 ARG C.164 ARG D.164 ASP D.162 HOH D.301 HOH D.302 HOH D.303
4F8B-MG-7 D1R2 ARG B.164 ARG E.164 ASP E.162 HOH E.301 HOH E.302 HOH E.303
4F8B-MG-8 D1R2 ARG B.164 ARG E.164 ASP E.162 HOH E.301 HOH E.302 HOH E.303