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merge pdb chains

Hello,

I am looking for tool/script that will modify a multiple chain (domain) pdb and merge all of the chains into a single chain and then renumber all of the residues and atoms so there are no clashes. I have spend a day looking without success so thought it may be better to post. Any ideas welcome. Thanks.

clustering pdb

1 answer

Try this: https://github.com/JoaoRodrigues/pdb-tools

More specifically, this will extract chains A and B from your pdb, rename them to chain A, and renumber the residues sequentially from 1. pdb_selchain.py -AB your.pdb | pdb_chain.py -A | pdb_reres.py -1 > new.pdb

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