Structure of PDB 3kh1 Chain A Binding Site BS01

Receptor Information
>3kh1 Chain A (length=196) Species: 272627 (Paramagnetospirillum magnetotacticum MS-1) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MIPFPESRLAAQMSFVVEIDKLKTILRQTLLTDSSRRENDAEHSWHIATM
AFLLAEYADEAVQIGRVARMLLIHDIVEIDAGDTFIHDEADKEERERKAA
ARLFGLLPPDQAAEYSALWQEYEARETADARFADALDRLQPLLHNFETEG
GTWKPHGVTRAKVDKLLPRIEAGSKRLGAYARALVDEAVRRGYLAP
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 chain3kh1 Chain A Residue 200 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB3kh1 Crystal structure of Predicted metal-dependent phosphohydrolase (ZP_00055740.2) from Magnetospirillum magnetotacticum MS-1 at 1.37 A resolution ;
Resolution1.37 Å
Binding residue
(original residue number in PDB)		T29 T155
Binding residue
(residue number reindexed from 1)		T29 T152
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0002953 5'-deoxynucleotidase activity
GO:0046872 metal ion binding
Cellular Component
GO:0005737 cytoplasm

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Molecular Function
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Cellular Component
External links
PDB RCSB:3kh1, PDBe:3kh1, PDBj:3kh1
PDBsum3kh1
PubMed
UniProtD1MPT5

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