Structure of PDB 6bnx Chain A Binding Site BS01

Receptor Information
>6bnx Chain A (length=281) Species: 4577 (Zea mays) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AAEAVVDWHKHDSKRMLHAVYRVGDLDRTIKYYTECFGMKLLRKRDVPDE
KYTNAFLGFGPENTNFAVELTYNYGVDKYDIGTGFGHFAIANDDVYKLAE
NIKSKGGKITREPGPVKGGSTVIAFAQDPDGYMFELIQRADTPEPLCQVM
LRVGDLERSIKFYEKALGMKLLRKKDVPDYKYTIAMLGYADEDKTTVLEL
TYNYGVTEYSKGNAYAQVAIGTNDVYKSAEAVDLATKELGGKILRQPGPL
PGINTKIASFVDPDGWKVELVDNTDFLKELH
Ligand information
Ligand IDCO
InChIInChI=1S/Co/q+2
InChIKeyXLJKHNWPARRRJB-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Co+2]
CACTVS 3.341[Co++]
FormulaCo
NameCOBALT (II) ION
ChEMBL
DrugBankDB14205
ZINC
PDB chain6bnx Chain A Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6bnx Deciphering the number and location of active sites in the monomeric glyoxalase I of Zea mays.
Resolution1.8 Å
Binding residue
(original residue number in PDB)		H96 E144 Q157 E208
Binding residue
(residue number reindexed from 1)		H87 E135 Q148 E199
Annotation score1
Enzymatic activity
Catalytic site (original residue number in PDB) H27 E78 H96 E144
Catalytic site (residue number reindexed from 1) H18 E69 H87 E135
Enzyme Commision number 4.4.1.5: lactoylglutathione lyase.
Gene Ontology
Molecular Function
GO:0004462 lactoylglutathione lyase activity
GO:0016829 lyase activity
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:6bnx, PDBe:6bnx, PDBj:6bnx
PDBsum6bnx
PubMed30993890
UniProtB6TPH0

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