Structure of PDB 5it5 Chain A Binding Site BS02

Receptor Information
>5it5 Chain A (length=385) Species: 274 (Thermus thermophilus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SAAQKFVKQVIREAFLQDASDIHIEPRQNDVQVRLRIDGALRPYSTLPKG
ALNAVISVVKIMGGLNIAEKRLPQDGRVRYREGAIDVDLRLSTLPTVYGE
KAVMRLLKKASDIPEIEDLGFAPGVFERFKEVISKPYGIFLITGPTGSGK
SFTTFSILKRIATPDKNTQTIEDPVEYEIPGINQTQVNPQAGLTFARALR
AFLRQDPDIIMVGEIRDSETAKIATEAALTGHLVIATLHTNDAAQAITRL
DEMGVEPFNISAALIGVLSQRLVRRVCEHCKVEVKPDPETLRRLGLSEAE
IQGARLYKGMGCERCGGTGYKGRYAIHELLVVDDEIRHAIVAGKSATEIK
EIARRKGMKTLREDGLYKALQGITTLEEVLARTIE
Ligand information
Ligand IDZN
InChIInChI=1S/Zn/q+2
InChIKeyPTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Zn+2]
FormulaZn
NameZINC ION
ChEMBLCHEMBL1236970
DrugBankDB14532
ZINC
PDB chain5it5 Chain A Residue 902 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB5it5 Crystal Structure of a Type IV Pilus Assembly ATPase: Insights into the Molecular Mechanism of PilB from Thermus thermophilus.
Resolution2.648 Å
Binding residue
(original residue number in PDB)		C782 C785 C817 C820
Binding residue
(residue number reindexed from 1)		C277 C280 C312 C315
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:5it5, PDBe:5it5, PDBj:5it5
PDBsum5it5
PubMed27667690
UniProtQ5SLC9|PILB_THET8 Type IV pilus assembly ATPase PilB (Gene Name=pilB)

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