MIE9R

Prompt

2.3.3.13

Transferases. Acyltransferases. Acyl groups converted into alkyl groups on transfer. 2-isopropylmalate synthase.

AI Generated Sequence

499 AAs
MKFDSKKYRYFPPLNLPDRQWPDKVITKAPIWCSVDLRDGNQALVDPMNVEQKLEFFKLLVDVGFKEIEVGFPSASDVEYDFVRTLIEQKMIPDDVYLQVLTQAREHLIKRTFEALKGAKRAIVHLYNSTSVAQREIVFNKSKEEIKKIAVEGAKLVRDLAAKAEGTQWQFEYSPESFTGTEVDFALEVCNAVMDVWKPTPENKAIINLPATVEMATPNVYADQIEWVSCHLNNRDNVIISLHPHNDRGTGVAAAELGLLAGADRVEGTLFGNGERTGNVDIVTLALNMYTHGVDPNLDFSNINRIVEVYEATTQMKVHERHPYAGKLVFTAFSGSHQDAISKGMAYMKEKNNTLWEVPYLPIDPKDLGRTYEAVIRVNSQSGKSGVAFILQANYGFNLPKAMQAEFGKYVQKVTDEHHKELNAEDIYKIFEETYLPQAAPISFVKYHTFNQGDGVRVEATITHNGKTQTIEGTGNGPLDAFVNALQELFGITLEVKDY

Ligand/Cofactor

acetyl-CoA

CC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O

Validation Metrics

PLDDT91.1
NLMSIM85.0
AACOMP93.9
Seqdif (SeqID)35.8 (TFH47988.1)
Structdif (F-Target)8.0 (3u6w A)

ProtNLM

NameScore
2-isopropylmalate synthase0.270
2.3.3.130.270
Alpha-IPM synthase0.230
Alpha-isopropylmalate synthase0.226
Pyruvate carboxyltransferase domain-containing protein0.000
Isopropylmalate isomerase0.000
Designed by MP, using an AMD MI250 GPU