Structure of PDB 8d2q Chain A Binding Site BS05

Receptor Information
>8d2q Chain A (length=906) Species: 351607 (Acidothermus cellulolyticus 11B) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GTVPVTWRLGVDVGERSIGLAAVSYEEDKPKEILAAVSWIHDGGVGDERS
GASRLALRGMARRARRLRRFRRARLRDLDMLLSELGWTPLPDKNVSPVDA
WLARKRLAEEYVVDETERRRLLGYAVSHMARHRGWRNPWTTIKDLKNLPQ
PSDSWERTRESLEARYSVSLEPGTVGQWAGYLLQRAPGIRLNPTQQSLSN
ATAFETRLRQEDVLWELRCIADVQGLPEDVVSNVIDAVFCQKRPSVPAER
IRPPLPALHEATGHPVVDRNLAILRKFLSSATMRWGPPQSIVVELARGAS
ESRERQAEEEAARRAHRKANDRIRAELRASGLSDPSPADLVRARLLELYD
CHCMYCGAPISWENSELDHIVPRTDGGSNRHENLAITCGACNKEKGRRPF
ASWAETSNRVQLRDVIDRVQKLKYSGNMYWTRDEFSRYKKSVVARLKRRT
SDPEVIQSIESTGYAAVALRDRLLSYGEKNGVAQVAVFRGGVTAEARRWL
DISIERLFSRVAIFAQSTSTKRLDRRHHAVDAVVLTTLTPGVAKTLADAR
SRRVSAEFWRRPSTEEPQSPAYRQWKESCSGLGDLLISTAARDSIAVAAP
LRLRPTGALHEETLRAFSEHTVGAAWKGAELRRIVEPEVYAAFLALTDPG
GRFLKVSPSEDVLPADENRHIVLSDRVLGPRDRVKLFPDDRGSIRVRGGA
AYIASFHHARVFRWGSSHSPSFALLRVSLADLAVAGLLRDGVDVFTAELP
PWTPAWRYASIALVKAVESGDAKQVGWLVPGDELDFGPEGVTTAAGDLSM
FLKYFPERHWVVTGFEDDKRINLKPAFLSAEQAEVLRTERSDRPDTLTEA
GEILAQFFPRCWRATVAKVLCHPGLTVIRRTALGQPRWRRGHLPYSWRPW
SADPWS
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 chain8d2q Chain A Residue 1201 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB8d2q Coupled catalytic states and the role of metal coordination in Cas9
Resolution2.58 Å
Binding residue
(original residue number in PDB)		D18 H749 H750
Binding residue
(residue number reindexed from 1)		D12 H527 H528
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0003676 nucleic acid binding
GO:0003677 DNA binding
GO:0003723 RNA binding
GO:0004519 endonuclease activity
GO:0008270 zinc ion binding
GO:0046872 metal ion binding
Biological Process
GO:0051607 defense response to virus

View graph for
Molecular Function
View graph for
Biological Process
External links
PDB RCSB:8d2q, PDBe:8d2q, PDBj:8d2q
PDBsum8d2q
PubMed38348449
UniProtA0LWB3

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