Structure of PDB 2h5y Chain A Binding Site BS03

Receptor Information

>2h5y Chain A (length=232) Species: 190486 (Xanthomonas citri pv. citri str. 306)

TAPVTVFAAASLKESMDEAATAYEKATGTPVRVSYAASSALARQIEQGAP
ADVFLSADLEWMDYLQQHGLVLPAQRHNLLGNTLVLVAPASSKLRVDPRA
PGAIAKALGENGRLAVGQTASVPAGKYAAAALRKLGQWDSVSNRLAESES
VRAALMLVSRGEAPLGIVYGSDARADAKVRVVATFPDDSHDAIVYPVAAL
KNSNNPATAAFVSWLGSKPAKAIFARRGFSLK

Ligand information

• Ligand ID: MOO
• InChI: InChI=1S/Mo.4O/q;;;2*-1
• InChIKey: MEFBJEMVZONFCJ-UHFFFAOYSA-N
• SMILES:
  OpenEye OEToolkits 1.5.0: [O-][Mo](=O)(=O)[O-]
  ACDLabs 10.04
  CACTVS 3.341: [O-][Mo]([O-])(=O)=O
• Formula: Mo O4
• Name: MOLYBDATE ION;
  MOLYBDATE
• DrugBank: DB15878
• PDB chain: 2h5y Chain A Residue 1300

Receptor-Ligand Complex Structure

Structure summary

• PDB: 2h5y Crystallization, data collection and phasing of the molybdate-binding protein of the phytopathogen Xanthomonas axonopodis pv. citri
• Resolution: 1.7 Å
• Binding residue (original residue number in PDB): A10 A11 S12 A38 S39 A58 V123 P124 A125 S151 V152 Y170
• Binding residue (residue number reindexed from 1): A9 A10 S11 A37 S38 A57 V122 P123 A124 S150 V151 Y169
• Annotation score: 4

Gene Ontology

Molecular Function

• GO:0030973 molybdate ion binding
• GO:0046872 metal ion binding
• GO:1901359 tungstate binding

Biological Process

• GO:0015689 molybdate ion transport

Cellular Component

• GO:0030288 outer membrane-bounded periplasmic space

External links

• PDB: RCSB:2h5y, PDBe:2h5y, PDBj:2h5y
• PDBsum: 2h5y
• PubMed: 16511325
• UniProt: Q8PHA1|MODA_XANAC Molybdate-binding protein ModA (Gene Name=modA)