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Structure of PDB 1lrq Chain B Binding Site BS01

Receptor Information >1lrq Chain B (length=255) Species: 63363 (Aquifex aeolicus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure] KFLVIAGPCAIESEELLLKVGEEIKRLSEKFKEVEFVFKSSFDKANRSSI HSFRGHGLEYGVKALRKVKEEFGLKITTDIHESWQAEPVAEVADIIQIPA FLCRQTDLLLAAAKTGRAVNVKKGQFLAPWDTKNVVEKLKFGGAKEIYLT ERGTTFGYNNLVVDFRSLPIMKQWAKVIYDATGSVQLPGGMREFIFPLIR AAVAVGCDGVFMETHPEPEKALSDASTQLPLSQLEGIIEAILEIREVASK YYETI

Ligand information Ligand ID PO4 InChI InChI=1S/H3O4P/c1-5(2,3)4/h(H3,1,2,3,4)/p-3 InChIKey NBIIXXVUZAFLBC-UHFFFAOYSA-K SMILES Software SMILES CACTVS 3.341 [O-][P]([O-])([O-])=O ACDLabs 10.04 [O-]P([O-])([O-])=O OpenEye OEToolkits 1.5.0 [O-]P(=O)([O-])[O-] Formula O4 P Name PHOSPHATE ION ChEMBL DrugBank DB14523 ZINC PDB chain 1lrq Chain B Residue 2268 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]

Receptor-Ligand Complex Structure Global view Local view Structure summary [Spin on] [Spin off] [Reset] [High quality] [Low quality] [White background] [Black background] [Spin on] [Spin off] [Reset] [High quality] [Low quality] [White background] [Black background] PDB 1lrq Function of His185 in Aquifex aeolicus 3-Deoxy-D-manno-octulosonate 8-Phosphate Synthase Resolution 1.8 Å Binding residue (original residue number in PDB) P2101 K2124 R2154 Binding residue (residue number reindexed from 1) P99 K122 R152 Annotation score 1

Enzymatic activity Enzyme Commision number 2.5.1.55: 3-deoxy-8-phosphooctulonate synthase.

Gene Ontology Molecular Function GO:0008676 3-deoxy-8-phosphooctulonate synthase activity GO:0016740 transferase activity

	Biological Process
GO:0009058	biosynthetic process
GO:0009103	lipopolysaccharide biosynthetic process
GO:0019294	keto-3-deoxy-D-manno-octulosonic acid biosynthetic process
GO:0046364	monosaccharide biosynthetic process

	Cellular Component
GO:0005737	cytoplasm
GO:0005829	cytosol

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