2024-01-27_00000288|medium|8VR2

Crystal structure of the Pcryo_0617 oxidoreductase/decarboxylase from Psychrobacter cryohalolentis K5 in the presence of NAD and UDP; X-ray diffraction 1.80Å
Protein #1 335 residues (96% resolved)

GHMIELTGKKIFITGGAGFIGSTLIGRLIENNEMIVYDNLERNTLKSQPFANHKNLTLIQGNVLDQEKIIEAAKGSEIFIHAAAIAGIDNTVKSPVRTMTVNMIGTANALEAAHQAGTVQRFLEFSTSEVFGSRAYRVDELNSTTTGAVGEARWTYAVSKLAGEHLTHAYNREHGLPTVTFRPFNVYGPGQIGEGAISIMIRKALNNEDIYIFGDGSQIRAWCYVDDMIDALMKALSVPQAIGESFNIGNARAITTIYGLAQTICRVLNSKSEIIFREALSADIELRIPNVDKSEELLGFKAQVDLEEGLIRTADWLSANMNDLPVMPDMFLKEK

GHMIELTGKKIFITGGAGFIGSTLIGRLIENNEMIVYDNLERNTLKSQPFANHKNLTLIQGNVLDQEKIIEAAKGSEIFIHAAAIAGIDNTVKSPVRTMTVNMIGTANALEAAHQAGTVQRFLEFSTSEVFGSRAYRVDELNSTTTGAVGEARWTYAVSKLAGEHLTHAYNREHGLPTVTFRPFNVYGPGQIGEGAISIMIRKALNNEDIYIFGDGSQIRAWCYVDDMIDALMKALSVPQAIGESFNIGNARAITTIYGLAQTICRVLNSKSEIIFREALSADIELRIPNVDKSEELLGFKAQVDLEEGLIRTADWLSANMNDLPVMPDMFLKEK
Non polymer #2 MES

InChI=1S/C6H13NO4S/c8-12(9,10)6-3-7-1-4-11-5-2-7/h1-6H2,(H,8,9,10)

C1COCC[NH+]1CCS(=O)(=O)[O-]
Non polymer #3 NA

InChI=1S/Na/q+1

[Na+]
Non polymer #4 NAD

InChI=1S/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1

c1cc(c[n+](c1)[C@H]2[C@@H]([C@@H]([C@H](O2)CO[P@@](=O)([O-])O[P@@](=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)n4cnc5c4ncnc5N)O)O)O)O)C(=O)N
Non polymer #5 UDP

InChI=1S/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1

C1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)CO[P@@](=O)(O)OP(=O)(O)O)O)O
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Reference