Structure of PDB 8q5n Chain A Binding Site BS01

Receptor Information
>8q5n Chain A (length=155) Species: 1206749 (Nitrolancea hollandica) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
NLTTRELLAVSRASLRELKRRGVIRSGNAPAGDYAELLVQRATDGELANA
SQKSWDIRTTEGDRLQVKARVITDEHANGERQLSTIRSWDFDAAVIVLFD
DNFRVWRAARVPAAIMKEAAYYSQHVRGYTVYAKDALLNHSEVEDWTEQL
RSVEQ
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 chain8q5n Chain A Residue 203 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB8q5n Structural analysis of the BisI family of modification dependent restriction endonucleases.
Resolution2.65 Å
Binding residue
(original residue number in PDB)		D70 Q80 V81
Binding residue
(residue number reindexed from 1)		D56 Q66 V67
Annotation score4
External links