Structure of PDB 4p3i Chain C Binding Site BS01

Receptor Information
>4p3i Chain C (length=282) Species: 1097017 (Norovirus Hu/GI.7/TCH-060/USA/2003) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
LTVPNIPLNNLANSRVPAMINKMTVSTDQNQVVQFQNGRCTLEGQLLGTT
PVSASQVARIRGKVFSTASGKGLNLTELDGTPYHASPAPLGFPDIGACDW
HVSTFKVDQNLSGDPMSRLDVKQNAPFAPHLGSIEFTSDQDPTGDQLGTL
AWVSPSTSGARVDPWKIPSYTHLAPPIFPPGFGEAIVYFMSDFPIVAQVP
CTLPQEFVSHFVEQQAPVRGEAALLHYVDPDTHRNLGEFKLYPDGFITCV
PNTGGGPQNLPTNGVFVFSSWVSRYYQLKPVG
Ligand information
Ligand IDGAL
InChIInChI=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
InChIKeyWQZGKKKJIJFFOK-FPRJBGLDSA-N
SMILES
SoftwareSMILES
CACTVS 3.370OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O
OpenEye OEToolkits 1.7.2C(C1C(C(C(C(O1)O)O)O)O)O
CACTVS 3.370OC[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O
ACDLabs 12.01OC1C(O)C(OC(O)C1O)CO
OpenEye OEToolkits 1.7.2C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O)O)O)O)O
FormulaC6 H12 O6
Namebeta-D-galactopyranose;
beta-D-galactose;
D-galactose;
galactose
ChEMBLCHEMBL300520
DrugBank
ZINCZINC000002597049
PDB chain4p3i Chain G Residue 2 [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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PDB4p3i Structural analysis of determinants of histo-blood group antigen binding specificity in genogroup I noroviruses.
Resolution1.6941 Å
Binding residue
(original residue number in PDB)		D332 H334 S387 P388 T390 S391
Binding residue
(residue number reindexed from 1)		D99 H101 S154 P155 T157 S158
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links