Structure of PDB 6hm3 Chain A Binding Site BS03

Receptor Information
>6hm3 Chain A (length=183) Species: 284812 (Schizosaccharomyces pombe 972h-) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SKPLKGFVICCTSIDLKQRTEISTKATKLGAAYRSDFTKDVTHLIAGDFD
TPKYKFAAKSRPDIKIMSSEWIPVLYESWVQGEDLDDGLLVDKHLLPTLF
KCRVCLTNIGQPERSRIENYVLKHGGTFCPDLTRDVTHLIAGTSSGRKYE
YALKWKINVVCVEWLWQSIQRNAVLEPQYFQLD
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 chain6hm3 Chain A Residue 204 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB6hm3 BRCT domains of the DNA damage checkpoint proteins TOPBP1/Rad4 display distinct specificities for phosphopeptide ligands.
Resolution1.77264 Å
Binding residue
(original residue number in PDB)		E166 W169 Q170
Binding residue
(residue number reindexed from 1)		E163 W166 Q167
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:6hm3, PDBe:6hm3, PDBj:6hm3
PDBsum6hm3
PubMed30295604
UniProtP32372|RAD4_SCHPO S-M checkpoint control protein rad4 (Gene Name=rad4)

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