MRN19

Prompt

3.7.1.11

Hydrolases. Acting on carbon-carbon bonds. In ketonic substances. cyclohexane-1,2-dione hydrolase.

AI Generated Sequence

620 AAs
MTGTIRLTMAQALVKFLDAQYTEVDGEKTPFFKGIWTIFGHGNVLGLGQALEQDAGELKVYQGRNEQGMAHAATAFAKQMHRRQIMACTSSIGPGATNMVTAAATATANRIPVLLLPGDTFATRQPDPVLQQIEQFHDLSISTNDAFRPVSKYWDRINRPEQLMTALPRAMRVLTDPAETGAVTLALPQDVQGEAYDFPESFFQKRVHRIERRQPDAAELAAAAAMIRAKKKPLIIAGGGVRYSEAADALAAFAETHGIPVAETQAGKSAVASDHPLNLGGVGVTGTLAANAIAKEADLVIGVGTRYTDFTTASKTLFQNPEVEFLTINVSRFDAYKLDALPLVADAKEGLAALAAELAGYAYRSGWTAEIAEGKAAWLAETERLNAYARALGEGYPDPALAALLNETLDEDATVVCAAGSLPGDLQKVWRSRDPNTYHMEYGYSCMGYEIAGGLGVKLAEPDREVYVMVGDGSYLMLNSELVTSVQEGKKITVVLFDNAGFGCINNLQMEHGMGSFNTEFRYRNANGKLDGPLIPIDFAANAESYGCKTYRVNTLEELKAALEDAKTQDVSTLIDIKVLPKTMTEGYESWWHVGVAEVSQRESVRAAYDAWKANLQQAR

Ligand/Cofactor

cyclohexane-1,2-dione

C1CCC(=O)C(=O)C1

Validation Metrics

PLDDT85.1
NLMSIM85.0
AACOMP93.5
Seqdif (SeqID)30.2 (WP_078408940.1)
Structdif (F-Target)6.7 (6lpi B)

ProtNLM

NameScore
3.7.1.220.356
3D-(3,5/4)-trihydroxycyclohexane-1,2-dione hydrolase0.312
3D-(3,5/4)-trihydroxycyclohexane-1,2-dione acylhydrolase (Decyclizing)0.142
THcHDO hydrolase0.105
Thiamine pyrophosphate protein central region0.013
3.7.1.-0.008
Designed by MP, using an AMD MI250 GPU