how about modify your selected part of protein into two molecules
| | Smith Liu | | 邮箱：smith_liu...@163.com | 签名由 网易邮箱大师 定制 在2017年12月03日 16:21，joy yang 写道： Dear All, can anyone shed a clue on how to define the suface area used in ccp4 sc (shape complementarity) script? The script that I could find on internet is as following: sc XYZIN a22.pdb SURFIN1 A.grasp_surf SURFIN2 B.grasp_surf \ SURFOUT1 A.sc_surf SURFOUT2 B.sc_surf <<eof-sc MOLECULE 1 CHAIN A MOLECULE 2 CHAIN B END eof-sc how would I define it if the interface is composed, say, by resi 25-86 from chain A and resi 33-67 from chain B (MolECULE 1) and the resi 1-42 from chain G(molecule 2)? Many thanks, Bei
