Structure of PDB 7dl7 Chain G Binding Site BS01

Receptor Information
>7dl7 Chain G (length=351) Species: 459349 (Candidatus Cloacimonas acidaminovorans str. Evry) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MKSNGCRYGTHRVIEPKGVLPQPAKILNNDMSEIWDNEMLIDVIRLNIDS
ASFHQIKNKLIAQGHQDLEKAFAEHAIELTNRTGKHKNEDTGSGGMFIGR
VAAIGDKFEMKEEVKVGDKIASLVSLSLTPLKINKVKKVLLDKDQMEIEG
QAILFSSGVYAKLPDDLDENLALSVLDVAGAPAQVERLVKPDDTVVIIGA
NGKSGILCNAVAKERAGICGKVIGVVRNENYIPTCKATGCDEVILAQATD
AITIQKEVSRLTNGKMADVVINVVNTEDTELPSIMAAKDRGMVYFFSMAT
SFTKAALGAEGIGADVDMMIGNGYAHHHSEIALDLLRRNSVLMKIFKERY
A
Ligand information
Ligand IDCA
InChIInChI=1S/Ca/q+2
InChIKeyBHPQYMZQTOCNFJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Ca++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Ca+2]
FormulaCa
NameCALCIUM ION
ChEMBL
DrugBankDB14577
ZINC
PDB chain7dl7 Chain G Residue 407 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7dl7 Crystal Structures and Catalytic Mechanism of l-erythro-3,5-Diaminohexanoate Dehydrogenase and Rational Engineering for Asymmetric Synthesis of beta-Amino Acids.
Resolution2.30066 Å
Binding residue
(original residue number in PDB)		N47 M96 F97
Binding residue
(residue number reindexed from 1)		N47 M96 F97
Annotation score1
Enzymatic activity
Enzyme Commision number 1.4.1.11: L-erythro-3,5-diaminohexanoate dehydrogenase.
Gene Ontology
Molecular Function
GO:0000166 nucleotide binding
GO:0016491 oxidoreductase activity
GO:0047124 L-erythro-3,5-diaminohexanoate dehydrogenase activity

View graph for
Molecular Function
External links
PDB RCSB:7dl7, PDBe:7dl7, PDBj:7dl7
PDBsum7dl7
PubMed33624917
UniProtB0VJ11

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