UniProt Q01166

Beta-lactamase (Q01166)

Beta-lactamase (UniProt Q01166), EC 3.5.2.6: 3 experimental structures and 1 predicted model on GenesisL1, 4 ligands bound, 6 pockets. Binding sites, druggability and experiment against prediction (TM-score) in GL1X.

UniProt: Q01166
Protein: Beta-lactamase
EC: 3.5.2.6
Experimental structures: 3
Predicted models: 1
Ligands: 4
Pockets: 6 · 0 records with a druggable one

Structures

4 records of Q01166 in the MolNFT archive: 3 experimental, 1 predicted.

Entry	Title	Method	Chains	Ligands	Pockets
8IX8	Crystal structure of Class A beta-lactamase BlaA WT - complex with Tebipenem	x-ray diffraction	A	TEB, PO4	2 (best 0.34)
8IXX	Crystal structure of Class A beta-lactamase BlaA WT - complex with Ertapenem	x-ray diffraction	A	1RG, PO4	2 (best 0.34)
8IY4	Crystal structure of Class A beta-lactamase BlaA WT - complex with Meropenem	x-ray diffraction	A	MER, PO4	2 (best 0.35)
Q01166	AlphaFold monomer V2.0 prediction for beta-lactamase (Q01166)	predicted	A	—	—

Ligands

PO4 · Phosphate ion · in 3 records
1RG · (4R,5S)-3-({(3S,5S)-5-[(3-carboxyphenyl) carbamoyl]pyrrolidin-3-yl}sulfanyl)-5-[(1S,2R)-1-formyl-2-hydroxypropyl]-4-methyl-4,5-dihydro-1H-pyrrole-2-carboxylic acid · in 1 record
MER · (4R,5S)-3-{[(3S,5S)-5-(dimethylcarbamoyl)pyrrolidin-3-yl]sulfanyl}-5-[(2S,3R)-3-hydroxy-1-oxobutan-2-yl]-4-methyl-4,5-dihydro-1H-pyrrole-2-carboxylic acid · in 1 record
TEB · (4R,5S)-3-(1-(4,5-dihydrothiazol-2-yl)azetidin-3-ylthio)-5-((2S,3R)-3-hydroxy-1-oxobutan-2-yl)-4-methyl-4,5- dihydro-1H-pyrrole-2-carboxylic acid · in 1 record

Experiment against prediction

8IY4 chain A against the predicted model Q01166: TM-score 1.00, RMSD 0.38 Å
8IXX chain A against the predicted model Q01166: TM-score 0.99, RMSD 0.83 Å
8IX8 chain A against the predicted model Q01166: TM-score 0.98, RMSD 0.83 Å

Elsewhere

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