2026-08-01_00000381
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medium
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9WVY
NDP-4-keto-6-deoxyglucose-3-dehydratase KsgR in complex with PMP and AKG;
X-ray diffraction 3.30Å
Protein #1
399 residues (97% resolved)
Raw Sequence ...
MEIIHAGGDGTLLSFGRPTYDEREIEAVVAALRSGELATGVTTRKFEAEFAESFGFAHALAVTSGSTANLLACAAMLELGRARPGDRVIVSGATFVSAVTPVVQLGLVPVFVDVAAGHVNVDLDLVEQAVVEHGARGVLLPHTLGQALPMDRLAEIKRRHGVFVIEDCCESLGAADGSTPVGSAADVATFSFYAGHHLTMGEGGVAAGHSAEIDSVLRSLRAFGRNPDYRLGRFEHPVDDRPLAPEERYIHLRLGYNAKITDFQAAFGRVQLTRHAELARQRRQLAQELVPVLREFGWGVLGDPVSPGASPFAVATLLPEGLPLTRAVGVLIEHGIDPRGFLGASQPHQPCFDGVTKVVHEPYLHTRTLAERGLLLGCPPRTDRAAAVKALRRALESLS
Canonical Sequence ...
MEIIHAGGDGTLLSFGRPTYDEREIEAVVAALRSGELATGVTTRKFEAEFAESFGFAHALAVTSGSTANLLACAAMLELGRARPGDRVIVSGATFVSAVTPVVQLGLVPVFVDVAAGHVNVDLDLVEQAVVEHGARGVLLPHTLGQALPMDRLAEIKRRHGVFVIEDCCESLGAADGSTPVGSAADVATFSFYAGHHLTMGEGGVAAGHSAEIDSVLRSLRAFGRNPDYRLGRFEHPVDDRPLAPEERYIHLRLGYNAKITDFQAAFGRVQLTRHAELARQRRQLAQELVPVLREFGWGVLGDPVSPGASPFAVATLLPEGLPLTRAVGVLIEHGIDPRGFLGASQPHQPCFDGVTKVVHEPYLHTRTLAERGLLLGCPPRTDRAAAVKALRRALESLS
Non polymer #2
AKG
InChI=1S/C5H6O5/c6-3(5(9)10)1-2-4(7)8/h1-2H2,(H,7,8)(H,9,10)
InChI=1S/C5H6O5/c6-3(5(9)10)1-2-4(7)8/h1-2H2,(H,7,8)(H,9,10)
SMILES: C(CC(=O)O)C(=O)C(=O)O
C(CC(=O)O)C(=O)C(=O)O
Non polymer #3
PMP
InChI=1S/C8H13N2O5P/c1-5-8(11)7(2-9)6(3-10-5)4-15-16(12,13)14/h3,11H,2,4,9H2,1H3,(H2,12,13,14)
InChI=1S/C8H13N2O5P/c1-5-8(11)7(2-9)6(3-10-5)4-15-16(12,13)14/h3,11H,2,4,9H2,1H3,(H2,12,13,14)
SMILES: Cc1c(c(c(cn1)COP(=O)(O)O)CN)O
Cc1c(c(c(cn1)COP(=O)(O)O)CN)O
Biounit #1
monomer
Download coordinates
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Model
Reference
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