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the missing residues, non-classical amino-acids, and sequence gaps have been replaced by a "X" symbol.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 2RJE MLY Q 20 LYS N-DIMETHYL-LYSINE LINK C ARG Q 19 N MLY Q 20 1555 1555 1.33 LINK C MLY Q 20 N VAL Q 21 1555 1555 1.33 HETATM 7709 N MLY Q 20 135.253 54.646 35.913 1.00 27.81 N HETATM 7710 CA MLY Q 20 135.531 54.882 34.504 1.00 27.10 C HETATM 7711 CB MLY Q 20 134.280 54.921 33.617 1.00 26.87 C HETATM 7712 CG MLY Q 20 133.671 53.536 33.342 1.00 25.24 C HETATM 7713 CD MLY Q 20 132.190 53.643 32.980 1.00 22.90 C HETATM 7714 CE MLY Q 20 131.553 52.251 32.816 1.00 20.15 C HETATM 7715 NZ MLY Q 20 130.073 52.354 32.775 1.00 21.29 N HETATM 7716 CH1 MLY Q 20 129.606 53.110 31.594 1.00 19.45 C HETATM 7717 CH2 MLY Q 20 129.524 50.971 32.730 1.00 19.62 C HETATM 7718 C MLY Q 20 136.169 56.245 34.477 1.00 28.06 C HETATM 7719 O MLY Q 20 135.702 57.152 35.147 1.00 27.63 O
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