MW70S

Prompt

6.2.1.71

Ligases. Forming carbon-sulfur bonds. Acid--thiol ligases. 2,3-dihydroxybenzoate--[aryl-carrier protein] ligase.

AI Generated Sequence

534 AAs
MTIGYTRWPDELAARYRAEGYWLDRPLTDILTRHAAEHPDATAIVCGERHFTYGELDRRVANLAAGLRARGLKPGDTALVQLPNVAEFYITFFALLKIGAVPVNALFSHRRLELNAYCAQIEPALYIADREHALFGDDAFAAALAAEVPSLRVVVLGNDGSEHSVADALAAPADAFATPTAPADVAFFQLSGGSTGTPKLIPRTHNDYDYSVRASVEICGLDAQTRFLCALPAAHNYPMSSPGALGVFHAGGCVVLAHDPSPADCFALIERHQVNVTALVPPLAVLWLQAIAPGGNDLASVKLLQVGGAKFSETLARRIPAELGCTLQQVFGMAEGLVNYTRLDDPEEVIFNTQGRPMSPDDEVRVADDDGNPVPPGEVGRLATRGPYTIRGYYKAPEHNAAAFDADGFYRSGDLVRITPEGYLIVEGREKDQINRGGEKIAAEEVENHLLAHPDVIHAALVAMPDELLGERSCAFVVARSPLKAVEVRRFLREQGIADYKLPDRFECIDALPLTAVGKVDKKRLRQALAERLA

Ligand/Cofactor

ATP

C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O)N

Validation Metrics

PLDDT90.1
NLMSIM85.0
AACOMP92.3
Seqdif (SeqID)29.3 (WP_024561518.1)
Structdif (F-Target)4.2 (1mdf A)

ProtNLM

NameScore
2,3-dihydroxybenzoate-AMP ligase0.311
2.7.7.580.301
(2,3-dihydroxybenzoyl)adenylate synthase0.178
Enterobactin synthase subunit E0.086
6.3.2.-0.053
AMP-binding protein0.011
Designed by MP, using an AMD MI250 GPU