Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MNRLKEKYNKEIAPALMTKFNYDSVMQVPKIEKIVINMGVGDAVQNAKAIDSAVEELTFIAGQKPVVTRAKKSIAGFRLREGMPIGAKVTLRGERMYDFLDKLISVSLPRVRDFRGVSKKSFDGRGNYTLGIKEQLIFPEIDYDKVTKVRGMDIVIVTTANTDEEARELLTQVGMPFQK
4WFN Chain:D ((3-179))
--QLKTKYNDQVRPALMQQFGYSSVMAVPRIEKIVVNEGLGSSKEDSKAIDKAAKELALITLQKPIITKAKKSISNFKLRQGMPVGIKVTLRGERMYVFLEKLINIGLPRIRDFRGINPNAFDGRGNYNLGIKEQLIFPEITYDMVDKTRGMDITIVTTAKTDEEARALLQSMGLPFRK
General information:
TITO was launched using:
RESULT:
Template:
4WFN.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -72735 for 1221 contacts (-59.6/contact) +
2D Compatibility (PS) -18951 + (NN) -6262 + (LL) 128
1D Compatibility (HY) -21200 + (ID) 5800
Total energy: -124820.0 ( -102.23 by residue)
QMean score : 0.567
(partial model without unconserved sides chains):
PDB file :
Tito_4WFN.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-4WFN-query.scw
PDB file :
Tito_Scwrl_4WFN.pdb
: