2024-07-20_00000233
|
ligand
|
8XYN
Structure of the engineered retro-aldolase RA95.5-8;
X-ray diffraction 2.30Å
Protein #1
256 residues (93% resolved)
Raw Sequence ...
MPRYLKGWLEDVVQLSLRRPSVHASRQRPIISLNERILEFNKRNITAIIAYYTRKSPSGLDVERDPIEYAKYMERYAVGLSIKTEEKYFNGSYEMLRKIASSVSIPILMNDFIVKESQIDDAYNLGADTVLLIVNILTERELESLLEYARSYGMEPLILINDENDLDIALRIGARFIVIFSMNFETGEINKENQRKLISMIPSNVVKVAKLDISERNEIEELRKLGVNAFLISSSLMRNPEKIKELIEGSHHHHHH
Canonical Sequence ...
MPRYLKGWLEDVVQLSLRRPSVHASRQRPIISLNERILEFNKRNITAIIAYYTRKSPSGLDVERDPIEYAKYMERYAVGLSIKTEEKYFNGSYEMLRKIASSVSIPILMNDFIVKESQIDDAYNLGADTVLLIVNILTERELESLLEYARSYGMEPLILINDENDLDIALRIGARFIVIFSMNFETGEINKENQRKLISMIPSNVVKVAKLDISERNEIEELRKLGVNAFLISSSLMRNPEKIKELIEGSHHHHHH
Non polymer #2
A1LXX
InChI=1S/C18H37NO2/c1-4-5-6-7-8-9-10-11-12-13-16-19(2,3)17-14-15-18(20)21/h4-17H2,1-3H3/p+1
InChI=1S/C18H37NO2/c1-4-5-6-7-8-9-10-11-12-13-16-19(2,3)17-14-15-18(20)21/h4-17H2,1-3H3/p+1
SMILES: CCCCCCCCCCCC[N+](C)(C)CCCC(=O)O
CCCCCCCCCCCC[N+](C)(C)CCCC(=O)O
Biounit #1
homo-dimer
Download coordinates
Tube
Model
Reference
100%