[phenixbb] RESOLVE density modification

Terwilliger, Thomas Charles terwilliger at lanl.gov
Mon Mar 9 08:18:15 PDT 2015


Hi Mark,
I'm sorry, this must be a bug in the program.  If you are running a recent version, can you possibly send me the input files and the full log file and I'll fix it?
Thanks a lot!
-Tom T

________________________________________
From: phenixbb-bounces at phenix-online.org [phenixbb-bounces at phenix-online.org] on behalf of Mark A Saper [saper at umich.edu]
Sent: Sunday, March 08, 2015 8:15 PM
To: phenixbb at phenix-online.org
Subject: [phenixbb] RESOLVE density modification

I am trying to run RESOLVE density modification with the output of a SAD Phaser run (dev-1965).  There are 3 input files: high resolution/experimental F’s and I’s, map coefficients and phases, and sequence.
I consistently get this error:
…
********************************************************************************
Failed to carry out AutoBuild_set_up_build:

For finding NCS from sites an MTZ file is required
********************************************************************************

I do not know which MTZ file is being referred to.  I have tried entering NCS as blank, 1, or turning it off in the NCS… options panel.  I also tried including the substructure PDB file.  Any suggestions?

-Mark
_________________________________
Mark A. Saper, Ph.D.
Associate Professor of Biological Chemistry, University of Michigan
Ann Arbor MI  48109-1055 U.S.A.
saper at umich.edu     phone (734) 764-3353     fax (734) 764-3323




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