Structure of PDB 4led Chain B Binding Site BS04

Receptor Information
>4led Chain B (length=252) Species: 1333543 (Pseudomonas aeruginosa str. C 1433) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ASSLAPRQVIRDGQFITSPNGKYKLVMQADGNLVLYEDGTKPIWNTTPVG
PGAKAVMEFNLNLYNKAGQVAWSSNVYTAYLFEEFKDEAYLNLQDDGDFG
IFSDEAKWGSIVLSRPEVGVKNKIIPTGTVMVPGTEYINGNYRLAFQGDG
NLVIYQINPQVVIWATYTMGADRAVVQEDGNFVIYKGTTALWHTHTATGM
PAYLKFTNTGKLFLSQPTLLWTLKRGSLSKPPKVIPGQHGPLDTTPIWSW
PH
Ligand information
Ligand IDXXR
InChIInChI=1S/C6H12O5/c1-2-3(7)4(8)5(9)6(10)11-2/h2-10H,1H3/t2-,3-,4+,5+,6+/m1/s1
InChIKeySHZGCJCMOBCMKK-PQMKYFCFSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.7.6C[C@@H]1[C@H]([C@@H]([C@@H]([C@H](O1)O)O)O)O
ACDLabs 12.01OC1C(O)C(OC(O)C1O)C
CACTVS 3.385C[C@H]1O[C@H](O)[C@@H](O)[C@@H](O)[C@@H]1O
OpenEye OEToolkits 1.7.6CC1C(C(C(C(O1)O)O)O)O
CACTVS 3.385C[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O
FormulaC6 H12 O5
Namealpha-D-rhamnopyranose;
alpha-D-rhamnose;
6-deoxy-alpha-D-mannopyranose;
D-rhamnose;
rhamnose
ChEMBL
DrugBank
ZINCZINC000001532676
PDB chain4led Chain B Residue 304 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB4led Lectin-Like Bacteriocins from Pseudomonas spp. Utilise D-Rhamnose Containing Lipopolysaccharide as a Cellular Receptor.
Resolution2.37 Å
Binding residue
(original residue number in PDB)
Q148 D150
Binding residue
(residue number reindexed from 1)
Q147 D149
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links