Structure of PDB 6x1z Chain A Binding Site BS02

Receptor Information
>6x1z Chain A (length=329) Species: 2336 (Thermotoga maritima) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
HHHHHVINLKELKILHTSDWHLGVTSWTSSRPVDRREELKKALDKVVEEA
EKREVDLILLTGDLLHSRNNPSVVALHDLLDYLKRMMRTAPVVVLPGNHD
WKGLKLFGNFVTSISSDITFVMSFEPVDVEAKRGQKVRILPFPYPDESEA
LRKNEGDFRFFLESRLNKLYEEALKKEDFAIFMGHFTVEGLAGYAGIEQG
REIIINRALIPSVVDYAALGHIHSFREIQKQPLTIYPGSLIRIDFGEEAD
EKGAVFVELKRGEPPRYERIDASPLPLKTLYYKKIDTSALKSIRDFCRNF
PGYVRVVYEEDSGILPDLMGEIDNLVKIE
Ligand information
Ligand IDMG
InChIInChI=1S/Mg/q+2
InChIKeyJLVVSXFLKOJNIY-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Mg+2]
CACTVS 3.341[Mg++]
FormulaMg
NameMAGNESIUM ION
ChEMBL
DrugBankDB01378
ZINC
PDB chain6x1z Chain A Residue 602 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6x1z Fragment- and structure-based drug discovery for developing therapeutic agents targeting the DNA Damage Response.
Resolution1.9 Å
Binding residue
(original residue number in PDB)		D58 N93 H180
Binding residue
(residue number reindexed from 1)		D63 N98 H185
Annotation score4
Enzymatic activity
Enzyme Commision number 3.1.-.-
Gene Ontology
Molecular Function
GO:0004519 endonuclease activity
GO:0008408 3'-5' exonuclease activity
GO:0016787 hydrolase activity
Biological Process
GO:0006259 DNA metabolic process

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Molecular Function
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Biological Process
External links
PDB RCSB:6x1z, PDBe:6x1z, PDBj:6x1z
PDBsum6x1z
PubMed33115610
UniProtQ9X1X0|MRE11_THEMA DNA double-strand break repair protein Mre11 (Gene Name=mre11)

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