Ki Summary

Reaction Details

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Target

Glutamate racemase

Ligand

BDBM50262013

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_514356 (CHEMBL967970)

IC50

55±n/a nM

Citation

Basarab, GS; Hill, PJ; Rastagar, A; Webborn, PJ Design of Helicobacter pylori glutamate racemase inhibitors as selective antibacterial agents: a novel pro-drug approach to increase exposure. Bioorg Med Chem Lett18:4716-22 (2008) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

Glutamate racemase

Name:

Glutamate racemase

Synonyms:

MURI_HELPY | glr | murI

Type:

PROTEIN

Mol. Mass.:

28413.39

Organism:

Helicobacter pylori

Description:

ChEMBL_475324

Residue:

255

Sequence:

MKIGVFDSGVGGFSVLKSLLKAQLFDEIIYYGDSARVPYGTKDPTTIKQFGLEALDFFKP
HQIKLLIVACNTASALALEEMQKHSKIPVVGVIEPSILAIKRQVKDKNAPILVLGTKATI
QSNAYDNALKQQGYLNVSHLATSLFVPLIEESILEGELLETCMRYYFTPLEILPEVVILG
CTHFPLIAQKIEGYFMEHFALSTPPLLIHSGDAIVEYLQQNYALKKNACAFPKVEFHASG
DVVWLEKQAKEWLKL

BDBM50262013

n/a

Name

BDBM50262013

Synonyms:

5-(2-((6-chloroquinolin-4-yl)methyl)-7-(cyclopropylmethyl)-5-methyl-4,6-dioxo-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-d]pyrimidin-3-yl)-N-methoxy-1-methyl-1H-pyrrole-3-sulfonamide | CHEMBL468004

Type

Small organic molecule

Emp. Form.

C26H26ClN7O5S

Mol. Mass.

584.047

SMILES

CONS(=O)(=O)c1cc(-c2n(Cc3ccnc4ccc(Cl)cc34)nc3n(CC4CC4)c(=O)n(C)c(=O)c23)n(C)c1 |(24.98,-9.2,;26.32,-9.96,;26.33,-11.5,;25,-12.28,;24.16,-10.99,;25.85,-13.57,;23.76,-13.19,;23.76,-14.73,;22.3,-15.21,;21.83,-16.67,;22.74,-17.93,;24.28,-17.93,;25.05,-19.26,;24.28,-20.59,;25.05,-21.93,;26.59,-21.93,;27.36,-20.58,;28.89,-20.58,;29.65,-19.24,;28.87,-17.92,;29.63,-16.58,;27.34,-17.93,;26.59,-19.26,;21.83,-19.18,;20.35,-18.7,;19.01,-19.47,;19.01,-21.01,;17.67,-21.78,;16.13,-21.78,;16.9,-23.12,;17.67,-18.7,;16.34,-19.47,;17.67,-17.15,;16.34,-16.38,;19.01,-16.37,;19.01,-14.83,;20.35,-17.15,;21.4,-13.96,;19.86,-13.97,;22.3,-12.72,)|

Structure