Reaction Details |
| Report a problem with these data |
Target | Thymidylate synthase |
---|
Ligand | BDBM18753 |
---|
Substrate/Competitor | BDBM18754 |
---|
Meas. Tech. | Thymidylate Synthase (TS) Assay |
---|
pH | 7.4±n/a |
---|
Temperature | 293.15±n/a K |
---|
Ki | 4100±n/a nM |
---|
Citation | Finer-Moore, JS; Anderson, AC; O'Neil, RH; Costi, MP; Ferrari, S; Krucinski, J; Stroud, RM The structure of Cryptococcus neoformans thymidylate synthase suggests strategies for using target dynamics for species-specific inhibition. Acta Crystallogr D Biol Crystallogr61:1320-34 (2005) [PubMed] Article |
---|
More Info.: | Get all data from this article, Inhibition_Run data, Solution Info, Assay Method |
---|
|
Thymidylate synthase |
---|
Name: | Thymidylate synthase |
Synonyms: | TMP1 | TSase | TYSY_CRYNB | Thymidylate Synthase (TS) |
Type: | Enzyme |
Mol. Mass.: | 35863.57 |
Organism: | Cryptococcus neoformans |
Description: | n/a |
Residue: | 317 |
Sequence: | MTATIDDQEKNQRSNPDHEEYQYLDLIRRIINVGEVRPDRTGTGTVALFAPPSFRFSLAD
NTLPLLTTKRVFLRGVIAELLWFVSGCTDAKMLSSQGVGIWDGNGSKEFLEKVGLGHRRE
GDLGPVYGFQWRHFGAEYTDADGDYKGKGVDQLQRVIDTIKNNPTDRRIILSAWNPKDLP
LMALPPCHMFCQFFVSLPPADSPGSKPKLSCLMYQRSCDLGLGVPFNIASYALLTHMIAL
ITDTEPHEFILQMGDAHVYRDHVEPLKTQLEREPRDFPKLKWARSKEEIGDIDGFKVEDF
VVEGYKPWGKIDMKMSA
|
|
|
BDBM18753 |
---|
BDBM18754 |
---|
Name | BDBM18753 |
Synonyms: | 4,4-bis(3-bromo-4-hydroxyphenyl)-10-chloro-3-oxatricyclo[7.3.1.0^{5,13}]trideca-1(12),5(13),6,8,10-pentaen-2-one | GA9 |
Type | Small organic molecule |
Emp. Form. | C24H13Br2ClO4 |
Mol. Mass. | 560.619 |
SMILES | Oc1ccc(cc1Br)C1(OC(=O)c2ccc(Cl)c3cccc1c23)c1ccc(O)c(Br)c1 |
Structure |
|