Structure of PDB 4xc3 Chain H Binding Site BS02
Receptor Information
>4xc3 Chain H (length=220) Species:
9606
(Homo sapiens) [
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QVQLVQSGAEVKRPGSSVTVSCKASGGSFSTYALSWVRQAPGRGLEWMGG
VIPLLTITNYAPRFQGRITITADRSTSTAYLELNSLRPEDTAVYYCAREG
TTGWGWLGKPIGAFAHWGQGTLVTVSSASTKGPSVFPLAPGTAALGCLVK
DYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQT
YICNVNHKPSNTKVDKKVEP
Ligand information
Ligand ID
1GP
InChI
InChI=1S/C3H9O6P/c4-1-3(5)2-9-10(6,7)8/h3-5H,1-2H2,(H2,6,7,8)/t3-/m0/s1
InChIKey
AWUCVROLDVIAJX-VKHMYHEASA-N
SMILES
Software
SMILES
OpenEye OEToolkits 1.5.0
C(C(COP(=O)(O)O)O)O
OpenEye OEToolkits 1.5.0
C([C@@H](COP(=O)(O)O)O)O
ACDLabs 10.04
O=P(O)(O)OCC(O)CO
CACTVS 3.341
OC[CH](O)CO[P](O)(O)=O
CACTVS 3.341
OC[C@H](O)CO[P](O)(O)=O
Formula
C3 H9 O6 P
Name
SN-GLYCEROL-1-PHOSPHATE
ChEMBL
DrugBank
ZINC
ZINC000003830895
PDB chain
4xc3 Chain H Residue 301 [
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Receptor-Ligand Complex Structure
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PDB
4xc3
Crystallographic Identification of Lipid as an Integral Component of the Epitope of HIV Broadly Neutralizing Antibody 4E10.
Resolution
1.63 Å
Binding residue
(original residue number in PDB)
S28 F29 S30
Binding residue
(residue number reindexed from 1)
S28 F29 S30
Annotation score
4
External links
PDB
RCSB:4xc3
,
PDBe:4xc3
,
PDBj:4xc3
PDBsum
4xc3
PubMed
26777395
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