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the missing residues, non-classical amino-acids, and sequence gaps have been replaced by a "X" symbol.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 2BQZ MLZ B 20 LYS N-METHYL-LYSINE LINK C ARG B 19 N MLZ B 20 1555 1555 1.34 LINK C MLZ B 20 N VAL B 21 1555 1555 1.44 SITE 4 AC1 16 HOH A2318 HIS B 18 MLZ B 20 HOH E2136 HETATM 1324 N MLZ B 20 3.617 -6.042 0.333 1.00 4.42 N ANISOU 1324 N MLZ B 20 507 619 551 25 -16 55 N HETATM 1325 CA MLZ B 20 3.308 -5.258 1.507 1.00 5.12 C ANISOU 1325 CA MLZ B 20 576 658 711 -57 -4 17 C HETATM 1326 CB MLZ B 20 2.292 -4.156 1.219 1.00 5.99 C ANISOU 1326 CB MLZ B 20 711 741 824 -1 -11 29 C HETATM 1327 CG MLZ B 20 2.729 -3.154 0.173 1.00 7.09 C ANISOU 1327 CG MLZ B 20 864 858 969 -70 -11 45 C HETATM 1328 CD MLZ B 20 1.584 -2.231 -0.283 1.00 9.21 C ANISOU 1328 CD MLZ B 20 1049 1118 1330 -12 47 74 C HETATM 1329 CE MLZ B 20 2.085 -1.650 -1.594 1.00 11.14 C ANISOU 1329 CE MLZ B 20 1276 1357 1599 -85 35 180 C HETATM 1330 NZ MLZ B 20 1.180 -1.000 -2.467 1.00 13.04 N ANISOU 1330 NZ MLZ B 20 1558 1843 1553 -83 15 182 N HETATM 1331 CM MLZ B 20 1.707 -0.310 -3.618 1.00 9.89 C ANISOU 1331 CM MLZ B 20 1168 1453 1136 -48 -14 0 C HETATM 1332 C MLZ B 20 2.734 -6.240 2.490 1.00 5.78 C ANISOU 1332 C MLZ B 20 759 707 727 -26 -17 24 C HETATM 1333 O MLZ B 20 2.064 -7.180 2.113 1.00 5.32 O ANISOU 1333 O MLZ B 20 598 648 776 -40 -55 -22 O
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