Structure of PDB 6tqe Chain A Binding Site BS02

Receptor Information

>6tqe Chain A (length=634) Species: 1773 (Mycobacterium tuberculosis)

MGPKLFKPSIDWSRAFPDSVYWVGKAWTISAICVLAILVLLRYLTPWGRQ
FWRITRAYFVGPNSVRVWLMLGVLLLSVVLAVRLNVLFSYQGNDMYTALQ
KAFEGIASGDGTVKRSGVRGFWMSIGVFSVMAVLHVTRVMADIYLTQRFI
IAWRVWLTHHLTQDWLDGRAYYRDLFIDETIDNPDQRIQQDVDIFTAGAG
GTPNAPSNGTASTLLFGAVQSIISVISFTAILWNLSGTLNIFGVSIPRAM
FWTVLVYVFVATVISFIIGRPLIWLSFRNEKLNAAFRYALVRLRDAAEAV
GFYRGERVEGTQLQRRFTPVIDNYRRYVRRSIAFNGWNLSVSQTIVPLPW
VIQAPRLFAGQIDFGDVGQTATSFGNIHDSLSFFRNNYDAFASFRAAIIR
LHGLVDANEKGRALPAVLTRPSDDESVELNDIEVRTPAGDRLIDPLDVRL
DRGGSLVITGRSGAGKTTLLRSLAELWPYASGTLHRPGGENETMFLSQLP
YVPLGTLRDVVCYPNSAAAIPDATLRDTLTKVALAPLCDRLDEERDWAKV
LSPGEQQRVAFARILLTKPKAVFLDGSTSALDTGLEFALYQLLRSELPDC
IVISVSHRPALERLHENQLELLGGGQWRLAPVEA

Ligand information

• Ligand ID: MG
• InChI: InChI=1S/Mg/q+2
• InChIKey: JLVVSXFLKOJNIY-UHFFFAOYSA-N
• SMILES:
  ACDLabs 10.04
  OpenEye OEToolkits 1.5.0: [Mg+2]
  CACTVS 3.341: [Mg++]
• Formula: Mg
• Name: MAGNESIUM ION
• DrugBank: DB01378
• PDB chain: 6tqe Chain A Residue 702

Receptor-Ligand Complex Structure

Structure summary

• PDB: 6tqe A mycobacterial ABC transporter mediates the uptake of hydrophilic compounds.
• Resolution: 4.3 Å
• Binding residue (original residue number in PDB): T467 Q498
• Binding residue (residue number reindexed from 1): T467 Q498
• Annotation score: 1

Enzymatic activity

• Enzyme Commision number: 7.6.2.-

Gene Ontology

Molecular Function

• GO:0005524 ATP binding
• GO:0016887 ATP hydrolysis activity
• GO:0140359 ABC-type transporter activity

Biological Process

• GO:0052572 response to host immune response
• GO:0055085 transmembrane transport

Cellular Component

• GO:0005576 extracellular region
• GO:0005886 plasma membrane
• GO:0016020 membrane

External links

• PDB: RCSB:6tqe, PDBe:6tqe, PDBj:6tqe
• PDBsum: 6tqe
• PubMed: 32296172
• UniProt: P9WQI9|BACA_MYCTU Hydrophilic compounds import ATP-binding/permease protein BacA (Gene Name=bacA)