Ki Summary

Reaction Details

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Target

Glutamate racemase

Ligand

BDBM50421044

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_842443 (CHEMBL2092116)

IC50

60±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

BDBM50421044

n/a

Name

BDBM50421044

Synonyms:

CHEMBL2087622

Type

Small organic molecule

Emp. Form.

C26H21ClN6O3

Mol. Mass.

500.936

SMILES

Cc1cc(oc1-c1n(Cc2ccnc3ccc(Cl)cc23)nc2n(CC3CC3)c(=O)n(C)c(=O)c12)C#N |(31.68,-12.9,;33.19,-13.24,;34.35,-12.23,;35.67,-13.02,;35.32,-14.53,;33.79,-14.66,;32.99,-15.98,;33.9,-17.22,;35.44,-17.22,;36.21,-18.56,;35.43,-19.89,;36.2,-21.22,;37.75,-21.22,;38.51,-19.87,;40.04,-19.87,;40.8,-18.54,;40.02,-17.21,;40.78,-15.87,;38.49,-17.23,;37.74,-18.55,;32.99,-18.47,;31.52,-17.99,;30.19,-18.75,;30.19,-20.29,;28.86,-21.06,;27.32,-21.07,;28.09,-22.4,;28.87,-17.99,;27.53,-18.76,;28.87,-16.45,;27.53,-15.69,;30.19,-15.67,;30.19,-14.13,;31.52,-16.45,;37.08,-12.42,;38.5,-11.82,)|

Structure