Structure of PDB 3i3f Chain C Binding Site BS01
Receptor Information
>3i3f Chain C (length=128) Species:
184922
(Giardia lamblia ATCC 50803) [
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TPTFLVCPDVVKFENVGQIAVVNGMVYLGGSVGIDKSGTLHKGLEEQTRQ
TFDNIRKCLEYANSGLDYIVSLNIFLSTSLSDSEEARFNELYREVFCVPA
TRPCRCCVRAQLQEGLLVEVVNVVAAQK
Ligand information
Ligand ID
BUA
InChI
InChI=1S/C4H8O2/c1-2-3-4(5)6/h2-3H2,1H3,(H,5,6)
InChIKey
FERIUCNNQQJTOY-UHFFFAOYSA-N
SMILES
Software
SMILES
OpenEye OEToolkits 2.0.7
CCCC(=O)O
CACTVS 3.385
CCCC(O)=O
Formula
C4 H8 O2
Name
butanoic acid
ChEMBL
CHEMBL14227
DrugBank
DB03568
ZINC
ZINC000000895132
PDB chain
3i3f Chain B Residue 142 [
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Receptor-Ligand Complex Structure
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PDB
3i3f
Hypothetical protein from Giardia lamblia GL50803_14299
Resolution
1.35 Å
Binding residue
(original residue number in PDB)
F26 V29 G43
Binding residue
(residue number reindexed from 1)
F13 V16 G30
Annotation score
1
Enzymatic activity
Enzyme Commision number
?
External links
PDB
RCSB:3i3f
,
PDBe:3i3f
,
PDBj:3i3f
PDBsum
3i3f
PubMed
UniProt
A8BD71
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