2025-02-08_00000110|medium|8Y7S

Crystal structure of a benzaldehyde lyase mutant M6 from Herbiconiux sp. SALV-R1; X-ray diffraction 2.68Å
Protein #1 558 residues (100% resolved)

MTATGGELVIRTLERASVDVAFGINGIHIDSIYQAALDRSFRIVDTRNEMNAGHAAEGYARAGHRLGVALLTAGGGFTNAVTSIANAHLDRTPVLYIAASGPLGVDETNTLQAGIDQVAIATPITKWAHRVTRVELLPRLIAQAIRIATHGPRGPVLLDIPWDVLTATVDDALADGVEELGAHALTAALGADAVERILDGLAGAERPVFIAGSELTRGDGGAALRRLAEITGTPLFSDTEALGAIRESPLSFGLLQGLFGLDEAERPDRVVLFGLRFGLATAHGSGILIPRDAAVVQIDSDARELGRLQPIELGAVGDPAAAAEELARAALTWAAGWPDRSRWQERLRELVDGRFESVTAQAVRDDRIHPMDAVTAIAETVPAGSVVVADGALTYLWLSETISRAPVADYLCHGYLSSMGVGVGTALGAQAADVTRPVVLVTGDGAVGYSLGEFDSMVRAGLPVVVVVLNNRAWGATLHAQELILGPDRVVNNRLENGSYSGVARALGADSIDVSDIADLAPTLREALASGRPTCIEVHVSLAPVPPELNVLLGGKPF

MTATGGELVIRTLERASVDVAFGINGIHIDSIYQAALDRSFRIVDTRNEMNAGHAAEGYARAGHRLGVALLTAGGGFTNAVTSIANAHLDRTPVLYIAASGPLGVDETNTLQAGIDQVAIATPITKWAHRVTRVELLPRLIAQAIRIATHGPRGPVLLDIPWDVLTATVDDALADGVEELGAHALTAALGADAVERILDGLAGAERPVFIAGSELTRGDGGAALRRLAEITGTPLFSDTEALGAIRESPLSFGLLQGLFGLDEAERPDRVVLFGLRFGLATAHGSGILIPRDAAVVQIDSDARELGRLQPIELGAVGDPAAAAEELARAALTWAAGWPDRSRWQERLRELVDGRFESVTAQAVRDDRIHPMDAVTAIAETVPAGSVVVADGALTYLWLSETISRAPVADYLCHGYLSSMGVGVGTALGAQAADVTRPVVLVTGDGAVGYSLGEFDSMVRAGLPVVVVVLNNRAWGATLHAQELILGPDRVVNNRLENGSYSGVARALGADSIDVSDIADLAPTLREALASGRPTCIEVHVSLAPVPPELNVLLGGKPF
Non polymer #2 MG

InChI=1S/Mg/q+2

[Mg+2]
Non polymer #3 TPP

InChI=1S/C12H18N4O7P2S/c1-8-11(3-4-22-25(20,21)23-24(17,18)19)26-7-16(8)6-10-5-14-9(2)15-12(10)13/h5,7H,3-4,6H2,1-2H3,(H4-,13,14,15,17,18,19,20,21)/p+1

Cc1c(sc[n+]1Cc2cnc(nc2N)C)CCO[P@](=O)(O)OP(=O)(O)O
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Reference