Ki Summary

Reaction Details

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Target

Glutamate racemase

Ligand

BDBM50421086

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_842443 (CHEMBL2092116)

IC50

41±n/a nM

Citation

Basarab, GS; Hill, P; Eyermann, CJ; Gowravaram, M; Käck, H; Osimoni, E Design of inhibitors of Helicobacter pylori glutamate racemase as selective antibacterial agents: incorporation of imidazoles onto a core pyrazolopyrimidinedione scaffold to improve bioavailabilty. Bioorg Med Chem Lett22:5600-7 (2012) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

Glutamate racemase

Name:

Glutamate racemase

Synonyms:

MURI_HELPJ | glr | murI

Type:

PROTEIN

Mol. Mass.:

28499.39

Organism:

Helicobacter pylori J99

Description:

ChEMBL_842443

Residue:

255

Sequence:

MKIGVFDSGVGGFSVLKSLLKARLFDEIIYYGDSARVPYGTKDPTTIKQFGLEALDFFKP
HEIELLIVACNTASALALEEMQKYSKIPIVGVIEPSILAIKRQVEDKNAPILVLGTKATI
QSNAYDNALKQQGYLNISHLATSLFVPLIEESILEGELLETCMHYYFTPLEILPEVIILG
CTHFPLIAQKIEGYFMGHFALPTPPLLIHSGDAIVEYLQQKYALKNNACTFPKVEFHASG
DVIWLERQAKEWLKL

BDBM50421086

n/a

Name

BDBM50421086

Synonyms:

CHEMBL2087620

Type

Small organic molecule

Emp. Form.

C24H22ClN7O2

Mol. Mass.

475.93

SMILES

Cn1cncc1-c1n(Cc2ccnc3ccc(Cl)cc23)nc2n(CC3CC3)c(=O)n(C)c(=O)c12 |(-4.9,-12.42,;-3.4,-12.77,;-2.23,-11.76,;-.91,-12.55,;-1.26,-14.05,;-2.79,-14.19,;-3.59,-15.5,;-2.68,-16.75,;-1.14,-16.75,;-.37,-18.08,;-1.15,-19.41,;-.38,-20.74,;1.16,-20.75,;1.93,-19.4,;3.46,-19.39,;4.22,-18.06,;3.44,-16.74,;4.2,-15.4,;1.91,-16.75,;1.16,-18.07,;-3.59,-18,;-5.06,-17.52,;-6.39,-18.28,;-6.39,-19.82,;-7.72,-20.59,;-9.26,-20.6,;-8.49,-21.93,;-7.72,-17.52,;-9.05,-18.29,;-7.72,-15.98,;-9.05,-15.21,;-6.39,-15.2,;-6.39,-13.66,;-5.06,-15.98,)|

Structure