Structure of PDB 6ive Chain E Binding Site BS01
Receptor Information
>6ive Chain E (length=167) Species:
300852
(Thermus thermophilus HB8) [
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SVYRFEDKTPAVHPTAFIAPGAYVVGAVEVGEGASIWFGAVVRGDLERVV
VGPGTNVQDGAVLHADPGFPCLLGPEVTVGHRAVVHGAVVEEGALVGMGA
VVLNGARIGKNAVVGAGAVVPPGMEVPEGRLALGVPARVVRPIDPPGNAP
RYRALAERYRKALFPVA
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
6ive Chain D Residue 202 [
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Receptor-Ligand Complex Structure
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PDB
6ive
Molecular structure of thermostable and zinc-ion-binding gamma-class carbonic anhydrases.
Resolution
2.3 Å
Binding residue
(original residue number in PDB)
N149 Y153
Binding residue
(residue number reindexed from 1)
N148 Y152
Annotation score
3
Enzymatic activity
Enzyme Commision number
?
External links
PDB
RCSB:6ive
,
PDBe:6ive
,
PDBj:6ive
PDBsum
6ive
PubMed
30895492
UniProt
Q5SH51
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