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Running D. Eisenberg's 3D-profile programs and the GCG package The source files are in /srv/local/eisenberg The executable files are in /srv/local/eisenberg It needs a .pdb file and a file with secondary structure endpoints; Secondary structure file is NOT free format - do it exactly as in the PDB, except that the only things read are "SHEET" or "HELIX", and res #'s. environments - input your coordinators & amp; secondary structure - assigns environments verify_3d - reads the output of environments - scores your sequence vs. your structure, averaged over a variable length window - output = a ".plotdat" file, renumbered, unfortunately. renum_plotdat. for is my little dittie to restore meaningful sequence #'s before plotting with curvy - see the commentary at the top of the code. profiler_3d - reads the output of environments - writes a profile file ".prf" that can be read by search.com OR by the GCG Wisconsin sequence database package. - The search.com is a command program in csbgln, a VAX/VMS system. Currently we don't have the GCG available in this Unix system, please ask Pat Fleming for more infomation about GCG. References for 3d profiles: Bowie, J.U., Luethy, R., and Eisenberg, D. "A Method to Identify Protein Sequences that Fold into a Known Three-Dimensional Structure" Science 253, 164-170 (1991). Luethy,R., Bowie,J.U., and Eisenberg,D. (1992) "Assessment of protein models with three-dimensional profiles", Nature 356, 83-85 (1992) References for profiles in general: Gribskov, Michael, McLachlan, Andrew D., and Eisenberg, David, "Profile analysis: Detection of distantly related proteins", Proc. Natl. Acad. Sci. (USA) 84, 4355-4358 (1987). Gribskov, M., Luethy, R., and Eisenberg, D., "Profile Analysis", in Methods in Enzymology, R.F. Doolittle, ed., Academic press, Vol. 183, 146-159 (1990).
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