Modeller
If you want to use this structure as a template for modelisation with Modeller, you can use the following sequence to build the alignment file "*.ali".
To avoid the classical Modeller error :
'Number of residues in the alignment and pdb files are different'(see FAQ n°17),
the missing residues, non-classical amino-acids, and sequence gaps have been replaced by a "X" symbol.
1) align this sequence with your sequence to modelised;
2) replace the "X" by "-" in the obtained alignement, then build your "*.ali" file;
3) use Modeller to make your models;
4) And finally use the following information found in the PDB to add this PTM in your models (see FAQ n°8 & 9 and this archive of Modeller usage).
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MODRES 3F9Y MLZ F 20 LYS N-METHYL-LYSINE SHEET 4 G 4 MLZ F 20 VAL F 21 1 O MLZ F 20 N TYR B 274 LINK C ARG F 19 N MLZ F 20 1555 1555 1.35 LINK C MLZ F 20 N VAL F 21 1555 1555 1.31 SITE 4 AC2 15 TRP B 349 HIS F 18 MLZ F 20 HETATM 2673 N MLZ F 20 -8.535 -6.432 -1.602 1.00 29.51 N HETATM 2674 CA MLZ F 20 -7.676 -6.143 -0.498 1.00 29.22 C HETATM 2675 CB MLZ F 20 -6.556 -5.142 -0.892 1.00 29.26 C HETATM 2676 CG MLZ F 20 -5.653 -5.761 -1.959 1.00 29.38 C HETATM 2677 CD MLZ F 20 -4.677 -4.720 -2.581 1.00 32.11 C HETATM 2678 CE MLZ F 20 -4.099 -5.297 -3.848 1.00 32.38 C HETATM 2679 NZ MLZ F 20 -3.200 -4.411 -4.520 1.00 31.22 N HETATM 2680 CM MLZ F 20 -2.639 -4.834 -5.751 1.00 32.66 C HETATM 2681 C MLZ F 20 -8.561 -5.507 0.567 1.00 27.51 C HETATM 2682 O MLZ F 20 -9.469 -4.699 0.183 1.00 28.80 O
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