Structure of PDB 8ugr Chain 5q Binding Site BS01

Receptor Information
>8ugr Chain 5q (length=145) Species: 9823 (Sus scrofa) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MELVQVLRRGLQQVSGHGGLRGYLRVLFRANDVRVGTLVGEDKYGNKYYE
DNKQFFGRHRWVIYTTEMNGRDTFWDVDGSMVPPEWHRWLHCMTDDPPTT
KPPTARKYIWTNHKFNVSGTPQQYVPYSTTRKKIQEWVPPSTPYK
Ligand information
Ligand IDAYA
InChIInChI=1S/C5H9NO3/c1-3(5(8)9)6-4(2)7/h3H,1-2H3,(H,6,7)(H,8,9)/t3-/m0/s1
InChIKeyKTHDTJVBEPMMGL-VKHMYHEASA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0CC(C(=O)O)NC(=O)C
CACTVS 3.341C[C@H](NC(C)=O)C(O)=O
CACTVS 3.341C[CH](NC(C)=O)C(O)=O
OpenEye OEToolkits 1.5.0C[C@@H](C(=O)O)NC(=O)C
ACDLabs 10.04O=C(NC(C(=O)O)C)C
FormulaC5 H9 N O3
NameN-ACETYLALANINE
ChEMBLCHEMBL1231115
DrugBankDB02518
ZINCZINC000000114134
PDB chain8ugr Chain 5q Residue 202 [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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PDB8ugr High-resolution in situ structures of mammalian respiratory supercomplexes.
Resolution6.5 Å
Binding residue
(original residue number in PDB)		Q54 F55 R58
Binding residue
(residue number reindexed from 1)		Q54 F55 R58
Annotation score1
Gene Ontology
Cellular Component
GO:0005739 mitochondrion
GO:0005743 mitochondrial inner membrane

View graph for
Cellular Component
External links
PDB RCSB:8ugr, PDBe:8ugr, PDBj:8ugr
PDBsum8ugr
PubMed38811722
UniProtF1SQP4

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