Structure of PDB 4i4y Chain B Binding Site BS04
Receptor Information
>4i4y Chain B (length=146) Species:
36056
(Boletus edulis) [
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VNFPNIPAEGVQFRLRARDTGYVIYSRTENPPLVWQYNGPPYDDQLFTLI
YGTGPRKNLYAIKSVPNGRVLFSRTSASPYVGNIAGDGTYNDNWFQFIQD
DNDPNSFRIYNLASDTVLYSRTTADPKFGNFTGAKYDDQLWHFELV
Ligand information
Ligand ID
SER
InChI
InChI=1S/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1
InChIKey
MTCFGRXMJLQNBG-REOHCLBHSA-N
SMILES
Software
SMILES
CACTVS 3.341
N[CH](CO)C(O)=O
OpenEye OEToolkits 1.5.0
C(C(C(=O)O)N)O
CACTVS 3.341
N[C@@H](CO)C(O)=O
ACDLabs 10.04
O=C(O)C(N)CO
OpenEye OEToolkits 1.5.0
C([C@@H](C(=O)O)N)O
Formula
C3 H7 N O3
Name
SERINE
ChEMBL
CHEMBL11298
DrugBank
DB00133
ZINC
ZINC000000895034
PDB chain
4i4y Chain B Residue 203 [
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Receptor-Ligand Complex Structure
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PDB
4i4y
BEL {beta}-trefoil: A novel lectin with antineoplastic properties in king bolete (Boletus edulis) mushrooms.
Resolution
1.9 Å
Binding residue
(original residue number in PDB)
Y37 N38
Binding residue
(residue number reindexed from 1)
Y37 N38
Annotation score
4
Enzymatic activity
Enzyme Commision number
?
External links
PDB
RCSB:4i4y
,
PDBe:4i4y
,
PDBj:4i4y
PDBsum
4i4y
PubMed
23213111
UniProt
R4GRU5
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