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the missing residues, non-classical amino-acids, and sequence gaps have been replaced by a "X" symbol.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 E 20 LYS N-METHYL-LYSINE SHEET 4 C 4 MLZ E 20 VAL E 21 1 O MLZ E 20 N TYR A 274 LINK C ARG E 19 N MLZ E 20 1555 1555 1.34 LINK C MLZ E 20 N VAL E 21 1555 1555 1.31 SITE 5 AC1 17 MLZ E 20 HETATM 2610 N MLZ E 20 -16.850 -9.722 23.733 1.00 28.98 N HETATM 2611 CA MLZ E 20 -18.101 -10.464 23.539 1.00 29.38 C HETATM 2612 CB MLZ E 20 -18.070 -11.396 22.316 1.00 28.94 C HETATM 2613 CG MLZ E 20 -17.829 -10.553 21.051 1.00 29.62 C HETATM 2614 CD MLZ E 20 -17.494 -11.496 19.855 1.00 32.60 C HETATM 2615 CE MLZ E 20 -16.978 -10.621 18.699 1.00 32.23 C HETATM 2616 NZ MLZ E 20 -16.469 -11.371 17.542 1.00 32.31 N HETATM 2617 CM MLZ E 20 -15.832 -10.542 16.553 1.00 31.48 C HETATM 2618 C MLZ E 20 -18.324 -11.270 24.783 1.00 28.98 C HETATM 2619 O MLZ E 20 -17.403 -11.745 25.401 1.00 29.17 O
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