BDBM163674 AN2690-AMP
SMILES: CC[C@H]1O[C@H]([C@H]2O[B-]3(OCc4cc(F)ccc34)OC12)n1cnc2c(N)ncnc12
InChI Key: InChIKey=WTUJYZMKPXKECI-TZVUDSRHSA-N
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Leucyl-tRNA synthetase (LeuRS) (Candida albicans (Ascomycetes)) | BDBM163674 (AN2690-AMP) | PDB UniProtKB/TrEMBL GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | n/a | 700 | n/a | n/a | n/a | 8.0 | 25 |
Grenoble Outstation and Unit of Virus Host-Cell Interactions, UJF-EMBL-CNRS, UMI 3265 | Assay Description ITC was performed using LeuRS CP1 domain wild-type, K510E mutant, or K510A mutant against AN2690-AMP at 25 °C by an ITC200 system (MicroCal, GE Healt... | ACS Chem Biol 10: 2277-85 (2015) Article DOI: 10.1021/acschembio.5b00291 BindingDB Entry DOI: 10.7270/Q29Z93N7 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Leucyl-tRNA synthetase K510A mutant (K510A) (Candida albicans (Ascomycetes)) | BDBM163674 (AN2690-AMP) | PDB GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | n/a | 4.60E+4 | n/a | n/a | n/a | 8.0 | 25 |
Grenoble Outstation and Unit of Virus Host-Cell Interactions, UJF-EMBL-CNRS, UMI 3265 | Assay Description ITC was performed using LeuRS CP1 domain wild-type, K510E mutant, or K510A mutant against AN2690-AMP at 25 °C by an ITC200 system (MicroCal, GE Healt... | ACS Chem Biol 10: 2277-85 (2015) Article DOI: 10.1021/acschembio.5b00291 BindingDB Entry DOI: 10.7270/Q29Z93N7 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Leucyl-tRNA synthetase K510E mutant (K510E) (Candida albicans (Ascomycetes)) | BDBM163674 (AN2690-AMP) | PDB GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | n/a | 2.10E+4 | n/a | n/a | n/a | 8.0 | 25 |
Grenoble Outstation and Unit of Virus Host-Cell Interactions, UJF-EMBL-CNRS, UMI 3265 | Assay Description ITC was performed using LeuRS CP1 domain wild-type, K510E mutant, or K510A mutant against AN2690-AMP at 25 °C by an ITC200 system (MicroCal, GE Healt... | ACS Chem Biol 10: 2277-85 (2015) Article DOI: 10.1021/acschembio.5b00291 BindingDB Entry DOI: 10.7270/Q29Z93N7 | |||||||||||
More data for this Ligand-Target Pair |
Cell (A) | Syringe (B) | Cell Links | Syringe Links | Cell + Syr Links | ΔG° kcal/mole | -TΔS° kcal/mole | ΔH° kcal/mole | log K | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|
Leucyl-tRNA synthetase (LeuRS) (Candida albicans (Ascomycetes)) | BDBM163674 (AN2690-AMP) | GoogleScholar PDB | PC cid PC sid | -8.36 | 7.12 | -1.00 | 6.13 | 8 | 25 | |
Grenoble Outstation and Unit of Virus Host-Cell Interactions, UJF-EMBL-CNRS, UMI 3265 | ACS Chem Biol 10: 2277-85 (2015) | |||||||||
Leucyl-tRNA synthetase K510E mutant (K510E) (Candida albicans (Ascomycetes)) | BDBM163674 (AN2690-AMP) | GoogleScholar PDB | PC cid PC sid | -6.45 | 4.77 | -1.50 | 4.73 | 8 | 25 | |
Grenoble Outstation and Unit of Virus Host-Cell Interactions, UJF-EMBL-CNRS, UMI 3265 | ACS Chem Biol 10: 2277-85 (2015) | |||||||||
Leucyl-tRNA synthetase K510A mutant (K510A) (Candida albicans (Ascomycetes)) | BDBM163674 (AN2690-AMP) | GoogleScholar PDB | PC cid PC sid | -5.97 | 4.27 | -1.50 | 4.38 | 8 | 25 | |
Grenoble Outstation and Unit of Virus Host-Cell Interactions, UJF-EMBL-CNRS, UMI 3265 | ACS Chem Biol 10: 2277-85 (2015) |