Structure of PDB 3waz Chain A Binding Site BS03
Receptor Information
>3waz Chain A (length=216) Species:
272844
(Pyrococcus abyssi GE5) [
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EASVSFENGKIVVRLPITRPTSKIRVKKIENGVGIPVSTRKKSFPSDENL
RDYYIEWQISYARDGKYDYELSRMVRLAHEHGILTYNDIYELLKFADDVK
SYLEDKGIRRESTNEELYGFNIYEDVYPVAKKELPSGEFIGIVLKHAQRA
VGYQSMVYVCIPLTNVEPSLAGRVARRNEVVKYEVPVDLMKELLKAFIIA
SETHKNDIVKFLRSII
Ligand information
Ligand ID
ADE
InChI
InChI=1S/C5H5N5/c6-4-3-5(9-1-7-3)10-2-8-4/h1-2H,(H3,6,7,8,9,10)
InChIKey
GFFGJBXGBJISGV-UHFFFAOYSA-N
SMILES
Software
SMILES
CACTVS 3.341
Nc1ncnc2[nH]cnc12
OpenEye OEToolkits 1.5.0
c1[nH]c2c(n1)c(ncn2)N
ACDLabs 10.04
n1c(c2ncnc2nc1)N
Formula
C5 H5 N5
Name
ADENINE
ChEMBL
CHEMBL226345
DrugBank
DB00173
ZINC
ZINC000000000882
PDB chain
3waz Chain A Residue 301 [
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Receptor-Ligand Complex Structure
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PDB
3waz
A sequence-specific DNA glycosylase mediates restriction-modification in Pyrococcus abyssi.
Resolution
3.0 Å
Binding residue
(original residue number in PDB)
Q65 I66 Y68 M163 V164 F204 H211
Binding residue
(residue number reindexed from 1)
Q58 I59 Y61 M156 V157 F197 H204
Annotation score
4
Enzymatic activity
Enzyme Commision number
?
External links
PDB
RCSB:3waz
,
PDBe:3waz
,
PDBj:3waz
PDBsum
3waz
PubMed
24458096
UniProt
Q9V2B6
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