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Structure of PDB 1w25 Chain A Binding Site BS01

Receptor Information >1w25 Chain A (length=454) Species: 190650 (Caulobacter vibrioides CB15) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure] SARILVVDDIEANVRLLEAKLTAEYYEVSTAMDGPTALAMAARDLPDIIL LDVMMPGMDGFTVCRKLKDDPTTRHIPVVLITALDGRGDRIQGLESGASD FLTKPIDDVMLFARVRSLTRFKLVIDELRQREASGRRMGVIAGAAARLDG LGGRVLIVDDNERQAQRVAAELGVEHRPVIESDPEKAKISAGGPVDLVIV NAAAKNFDGLRFTAALRSEERTRQLPVLAMVDPDDRGRMVKALEIGVNDI LSRPIDPQELSARVKTQIQRKRYTDYLRNNLDHSLELAVTDQLTGLHNRR YMTGQLDSLVKRATLGGDPVSALLIDIDFFKKINDTFGHDIGDEVLREFA LRLASNVRAIDLPCRYGGEEFVVIMPDTALADALRIAERIRMHVSGSPFT VAHGREMLNVTISIGVSATAGEGDTPEALLKRADEGVYQAKASGRNAVVG KAAH

Ligand information Ligand ID MG InChI InChI=1S/Mg/q+2 InChIKey JLVVSXFLKOJNIY-UHFFFAOYSA-N SMILES Software SMILES ACDLabs 10.04 OpenEye OEToolkits 1.5.0 [Mg+2] CACTVS 3.341 [Mg++] Formula Mg Name MAGNESIUM ION ChEMBL DrugBank DB01378 ZINC PDB chain 1w25 Chain A Residue 500 [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 1w25 Structural Basis of Activity and Allosteric Control of Diguanylate Cyclase Resolution 2.7 Å Binding residue (original residue number in PDB) D9 D10 D53 M55 Binding residue (residue number reindexed from 1) D8 D9 D52 M54 Annotation score 1 Binding affinity Manual survey: Ki=0.5uM (15569936)

Enzymatic activity Enzyme Commision number 2.7.7.65: diguanylate cyclase.

Gene Ontology Molecular Function GO:0005525 GTP binding GO:0016740 transferase activity GO:0046872 metal ion binding GO:0052621 diguanylate cyclase activity

	Biological Process
GO:0000160	phosphorelay signal transduction system
GO:0030154	cell differentiation
GO:0043709	cell adhesion involved in single-species biofilm formation
GO:1902201	negative regulation of bacterial-type flagellum-dependent cell motility

	Cellular Component
GO:0005737	cytoplasm
GO:0005886	plasma membrane

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