Structure of PDB 5znt Chain A Binding Site BS01

Receptor Information
>5znt Chain A (length=379) Species: 7091 (Bombyx mori) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PNRAPPCDSSQCVLPDCFCSEDGTVIPGDLPARDVPQMITITFDDAINNN
NIELYKEIFNGKRKNPNGCDIKATYFVSHKYTNYSAVQETHRKGHEIAVH
SITHNDDERFWSNATVDDWGKEMAGMRVIIEKFSNITDNSVVGVRAPYLR
VGGNNQFTMMEEQAFLYDSTITAPLSNPPLWPYTMYFRMPHRCHGNLQSC
PTRSHAVWEMVMNELDRREDPSNDEYLPGCAMVDSCSNILTGDQFYNFLN
HNFDRHYEQNRAPLGLYFHAAWLKNNPEFLEAFLYWIDEILQSHNDVYFV
TMTQVIQWVQNPRTVTEAKNFEPWREKCSVEGNPACWVPHSCKLTSKEVP
GETINLQTCLRCPVNYPWLNDPTGDGHYH
Ligand information
Ligand IDZN
InChIInChI=1S/Zn/q+2
InChIKeyPTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0
[Zn+2]
FormulaZn
NameZINC ION
ChEMBLCHEMBL1236970
DrugBankDB14532
ZINC
PDB chain5znt Chain A Residue 601 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5znt Structural and biochemical insights into the catalytic mechanisms of two insect chitin deacetylases of the carbohydrate esterase 4 family.
Resolution1.979 Å
Binding residue
(original residue number in PDB)
D206 H261 H265
Binding residue
(residue number reindexed from 1)
D45 H100 H104
Annotation score1
Enzymatic activity
Enzyme Commision number 3.5.1.41: chitin deacetylase.
Gene Ontology
Molecular Function
GO:0016810 hydrolase activity, acting on carbon-nitrogen (but not peptide) bonds
Biological Process
GO:0005975 carbohydrate metabolic process

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Molecular Function

View graph for
Biological Process
External links
PDB RCSB:5znt, PDBe:5znt, PDBj:5znt
PDBsum5znt
PubMed30755482
UniProtH9J9M0|CDA1_BOMMO Chitin deacetylase 1 (Gene Name=CDA1)

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