Make sure everything is built. Sometimes it is the crystallisation agents that 
sit at surprising places: 
https://onlinelibrary.wiley.com/doi/full/10.1002/pro.2923

Cheers,
Robbie

> -----Original Message-----
> From: CCP4 bulletin board <CCP4BB@JISCMAIL.AC.UK> On Behalf Of
> Murpholino Peligro
> Sent: Tuesday, April 9, 2024 03:39
> To: CCP4BB@JISCMAIL.AC.UK
> Subject: [ccp4bb] How to compare the same protein crystallized in different
> conditions?
> 
> Hi...
> Let's say I want to compare the same protein crystallized in different
> conditions. Same space group, almost same resolution. The global RMSD will
> be pretty small (around 0.3 Angstroms). There will be some changes in
> rotamers in some residues and some extra waters here and there... Besides
> local rsmd and contact maps (or differences in contact maps)... is there
> anything else to get a decent view of these small changes?
> 
> 
> Thanks a lot.
> 
> 
> 
> 
> 
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