Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MHNDLKEVLLTEEDIQNICKELGAQLTKDYQGK-------PLVCVGILKGSAMFMSDLIKRI---DTHLSIDFMDVSSYHGGTESTGEVQIIKDLGSSIENKDVLIIEDILETGTTLKSITELLQSRKVNSLEIVTLLDKPNRRKADIEAKYVGKKIPDEFVVGYGLDYRELYRNLPYIGTLKPEVYSN
1I13 Chain:A ((9-191))
-----EKILFTEEEIRTRIKEVAKRIADDYKGKGLRPYVNPLVLISVLKGSFMFTADLCRALCDFNVPVRMEFICVSSYGEGLTSSGQVRMLLDTRHSIEGHHVLIVEDIVATALTLNYLYHMYFTRRPASLKTVVLLDKREGRRVPFSADYVVANIPNAFVIGYGLDYDDTYRELRDIVVLRPEVYA-
General information:
TITO was launched using:
RESULT:
Template:
1I13.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -123382 for 1333 contacts (-92.6/contact) +
2D Compatibility (PS) -18680 + (NN) -2897 + (LL) 192
1D Compatibility (HY) -20800 + (ID) 3750
Total energy: -169317.0 ( -127.02 by residue)
QMean score : 0.499
(partial model without unconserved sides chains):
PDB file :
Tito_1I13.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-1I13-query.scw
PDB file :
Tito_Scwrl_1I13.pdb
: