Structure of PDB 3hp8 Chain A Binding Site BS03
Receptor Information
>3hp8 Chain A (length=107) Species:
42251,367110
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MSYADSSRNAVLTNGGRTLRAECRNADGNWVTSELDLDTIIGNNDGHFQW
GGQNFTETAEDIRFHPKEGAAEQPILRARLRDCNGEFHDRDVNLNRIQNV
NGRLVFQ
Ligand information
Ligand ID
GLC
InChI
InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6+/m1/s1
InChIKey
WQZGKKKJIJFFOK-DVKNGEFBSA-N
SMILES
Software
SMILES
OpenEye OEToolkits 1.5.0
C(C1C(C(C(C(O1)O)O)O)O)O
OpenEye OEToolkits 1.5.0
C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O)O)O)O)O
CACTVS 3.341
OC[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O
CACTVS 3.341
OC[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@@H]1O
ACDLabs 10.04
OC1C(O)C(OC(O)C1O)CO
Formula
C6 H12 O6
Name
alpha-D-glucopyranose;
alpha-D-glucose;
D-glucose;
glucose
ChEMBL
CHEMBL423707
DrugBank
ZINC
ZINC000003861213
PDB chain
3hp8 Chain D Residue 1 [
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Receptor-Ligand Complex Structure
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PDB
3hp8
A designed chimeric cyanovirin-N homolog lectin: Structure and molecular basis of sucrose binding.
Resolution
2.0 Å
Binding residue
(original residue number in PDB)
S2 Y3 S6 Q98 N99
Binding residue
(residue number reindexed from 1)
S2 Y3 S6 Q98 N99
Annotation score
4
Enzymatic activity
Enzyme Commision number
?
External links
PDB
RCSB:3hp8
,
PDBe:3hp8
,
PDBj:3hp8
PDBsum
3hp8
PubMed
19639634
UniProt
Q5MK11
;
Q7S6U4
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