Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MKIGIIAAMEEELKLLVENLEDKSQETVLS-NVYYSGRYGEHELVLVQSGVGKVMSAMSVAILVESFKVDAIINTGSAGAVATGLNVGDVVVADTLVYHDVDLTAFGYDYGQMSMQPLYFHSDKTFVSTFEAVLSKEEMTSKVGLIATGDSFIAGQEKIDVIKGHFPQVLAVEMEGAAIAQAAQATGKPFVVVRAMSDTAAHDANITFDEFIIEAGKRSAQVLMAFLKAL
3NM4 Chain:A ((3-226))
-KIGILGAMREEITPILELFGVDFEEIPLGGNVFHKGVYHNKEIIVAYSKIGKVHSTLTTTSMILAFGVQKVLFSGVAGSLVKDLKINDLLVATQLVQHDVDLSAFDHPLGFIPESAIFIETSGSLNALAKKIANEQHIALKEGVIASGDQFVHSKERKEFLVSEF-KASAVEMEGASVAFVCQKFGVPCCVLRSISDNADEKAGMSFDEFL----EKSAHTSAKFLKSM
General information:
TITO was launched using:
RESULT:
Template:
3NM4.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -161999 for 2003 contacts (-80.9/contact) +
2D Compatibility (PS) -23864 + (NN) -7014 + (LL) 348
1D Compatibility (HY) -18000 + (ID) 3750
Total energy: -214279.0 ( -106.98 by residue)
QMean score : 0.541
(partial model without unconserved sides chains):
PDB file :
Tito_3NM4.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3NM4-query.scw
PDB file :
Tito_Scwrl_3NM4.pdb
: