Structure of PDB 7auc Chain A Binding Site BS04

Receptor Information
>7auc Chain A (length=493) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
LKHERFQSLSFPHTKEMMKIFHKKFGLHNFRTNQLEAINAALLGEDCFIL
MPTGGGKSLCYQLPACVSPGVTVVISPLRSLIVDQVQKLTSLDIPATYLT
GSEATNIYLQLSKKDPIIKLLYVTPEKICASNRLISTLENLYERKLLARF
VIDEAHMLRQKFPSVPVMALTATANPRVQKDILTQLKILRPQVFSMSFNR
HNLKYYVLPKKPKKVAFDCLEWIRKHHPYDSGIIYCLSRRECDTMADTLQ
RDGLAALAYHAGLSDSARDEVQQKWINQDGCQVICATIAFGMGIDKPDVR
FVIHASLPKSVEGYYQESGRAGRDGEISHCLLFYTYHDVTRLKRLIMMEK
DGNHHTRETHFNNLYSMVHYCENITECRRIQLLAYFGENGFNPDFCKKHP
DVSCDNCCKKVSQREEMVKKCLGELTEVCKSLGKVFGVHYFNIFNTVTLK
KLAESLSSDPEVLLQIDGVTEDKLEKYGAEVISVLQKYSEWTS
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 chain7auc Chain A Residue 1519 [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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PDB7auc Uncovering an allosteric mode of action for a selective inhibitor of human Bloom syndrome protein.
Resolution1.53 Å
Binding residue
(original residue number in PDB)		E1047 F1050
Binding residue
(residue number reindexed from 1)		E388 F391
Annotation score1
Enzymatic activity
Enzyme Commision number 5.6.2.4: DNA 3'-5' helicase.
Gene Ontology
Molecular Function
GO:0000166 nucleotide binding
GO:0003676 nucleic acid binding
GO:0004386 helicase activity
GO:0005524 ATP binding
Biological Process
GO:0006310 DNA recombination
GO:0044237 cellular metabolic process

View graph for
Molecular Function
View graph for
Biological Process
External links
PDB RCSB:7auc, PDBe:7auc, PDBj:7auc
PDBsum7auc
PubMed33647232
UniProtP54132|BLM_HUMAN RecQ-like DNA helicase BLM (Gene Name=BLM)

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