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Target
Threonine--tRNA ligase
Ligand
BDBM50129555
Substrate
n/a
Meas. Tech.
ChEMBL_891959 (CHEMBL3049465)
IC50
8000±n/a nM
Citation
 Gao, YM; Wang, XJ; Zhang, J; Li, M; Liu, CX; An, J; Jiang, L; Xiang, WS Borrelidin, a potent antifungal agent: insight into the antifungal mechanism against Phytophthora sojae. J Agric Food Chem 60:9874-81 (2012) [PubMed]  Article 
Target
Name:
Threonine--tRNA ligase
Synonyms:
6.1.1.3 | Threonyl-tRNA synthase
Type:
PROTEIN
Mol. Mass.:
83673.00
Organism:
Phytophthora sojae
Description:
ChEMBL_106579
Residue:
744
Sequence:
MSSEPARVQTRLTKESGPKVTGAASEAKIGGPFTLTPNPPFVAARVAVYDRIMAGQKAQLEALAAKQTPIKITLPDGAVKEGVAWQTTPLDVALEISQGLADQVVVARVTYRGKPEDPFSVTAADVDGNEASDKAGEACCGAVADSSELWDVFRPLIGDCKLELLKFDDQEGRMVFWHSSAHILGESLETLKGAHLTIGPPVEGGFYYDSYMGTETVPESDLSVIEKACQKVVKDKQKFERIVLTKEEALEMFADNVFKTQIISTKIPDGGKTTAYRCGPLIDLCRGPHVPHTGKIKALAVTRASSSHWLGKTTNDTLQRVYGISFPDKNKMKEWKHFQAEAAKRDHRRLGVSEELFFFHSLSPGSGFWLPHGSAIYFKLLKFIREQYRARGYTEVITPNIFNMELWNISGHAKHYKENMFVFDVEGQEYALKPMNCPAASLMFDFRQRSYRELPIRYADCGVLHRNELSGALTGLTRVRRFQQDDAHIFCRDDQIKKEVLDFLSFMKYVYDVFGIEFNLELSTRPEKAMGELEQWERAESQLAEALDEFVGAGKWVVNPGDGAFYGPKIDIMITDALKRQHQCATVQLDFQLPIRFNLKYRTDDADNFKRPVIIHRAIYGSLERFVAVLVEHYAGKFPFWLSPRQVLIVTVGAAFVDYGYEVKDAMFRAGFDVDIDDTGKTLNKKIREGQMAHYNFILVVGAHEKETRSVNIRTRDNKVTGTKTLEEAIAMFKELEETKAADE
  
Inhibitor
Name:
BDBM50129555
Synonyms:
(1R,2R)-2-((4E,6Z)-(2S,8R,9S,11R,13S,15S,16S)-7-cyano-8,16-dihydroxy-9,11,13,15-tetramethyl-18-oxo-oxacyclooctadeca-4,6-dien-2-yl)-cyclopentanecarboxylic acid | 2-((1S,8R,9S,11R,13S,15S,18R)-7-Cyano-16-(S)-hydroxy-8-hydroxy-9,11,13,15-tetramethyl-18-oxo-oxacyclooctadeca-4,6-dien-2-yl)-cyclopentanecarboxylic acid | CHEMBL70590 | cid_310900
Type:
Small organic molecule
Emp. Form.:
C28H43NO6
Mol. Mass.:
489.6441
SMILES:
C[C@H]1C[C@@H](C)C[C@H](C)[C@@H](O)\C(=C/C=C/C[C@H](OC(=O)C[C@H](O)[C@@H](C)C1)[C@@H]1CCC[C@H]1C(O)=O)C#N |c:10,t:12|
Structure:
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