On Feb 24, 2010, at 10:23 AM, ucbccka wrote:
********************************* Sorry, input labels or map type unclear for phaser_1.1_refmac1.mtz For lig_map_type=pre_calculated_map_coeffs supply F and PHI (optionally FOM) (or 2FOFCWT and PH2FOFCWT) For lig_map_type=fo-fc_difference_map supply one column label for FP For lig_map_type=fobs_map supply one column label for FP
Please specify which lig_map_type above you would like and also specify the necessary input column labels for your map like one of these samples: input_labels="FP" input_labels="2FOFCWT PH2FOFCWT" input_labels="FP PHIB FOM" ************************************* phenix.ligandfit data=phaser_1.1_refmac1.mtz model=phaser_1.1_refmac1.pdb ligand=ATP.pdb input_labels="DELFWT PHDELWT"
What happens when you add "lig_map_type=pre_calculated_map_coeffs"
I even used the GUI, it recognises all the pairs of labels giving me the options to look at each map if I want and then..... complains that my labels are unclear.
Might be a bug - I'll see if I can reproduce this. Could you please send me (not the list) the log file from the GUI run? -Nat ------------------- Nathaniel Echols Lawrence Berkeley Lab 510-486-5136 [email protected]