Re: [ccp4bb] COOT FLEV error

2022-01-26 Thread Xavier Brazzolotto
This is probably a FLEV specific issue. Have you tried external software such as LigPlot+ or Schrodinger’s Maestro to see if they can better handle the modified residue ? > Le 27 janv. 2022 à 01:03, Sergio A. Sampieri a écrit : > > Greetings all, > > Sorry for the naive question, but I'm havin

[ccp4bb] COOT FLEV error

2022-01-26 Thread Sergio A. Sampieri
Greetings all, Sorry for the naive question, but I'm having problems trying to FLEV a modified residue in COOT. I have modeled a modified CYS into an structure following these steps: 1. Generate a SMILES string for L-cysteine bonded the modification. C1=CC=C(C=C1)C(=O)SCC(C(O)=O)N. htt