Atom O1 in residue HIS 180 was not found in rtp entry HISE with 17 atoms while sorting atoms

GROMACS version: 2023.4
GROMACS modification: Yes/No
Here post your question
When i run ’gmx pdb2gmx -f … -p … -water spce -ignh‘ , error occurs,“Fatal error: Atom O1 in residue HIS 180 was not found in rtp entry HISE with 17 atoms while sorting atoms.”

The program found an extra atom in HIS 180 that it wasn’t expecting to find in a HISE residue. This suggests something is wrong with the structure the residue HIS 180 in your pdb file