Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MPHEPHEPLTPPFSALPDPAGAPSRRQSRQRPQLSSDSPSAFRASRSHSRNATRSHSHSHSPRHSLRHSPGSGSCGSSSGHRPCADILEVGMLLSKINSLAHLRAAPCNDLHATKLAPGKEKEPLESQYQVGPLLGSGGFGSVYSGIRVSDNLPVAIKHVEKDRISDWGELPNGTRVPMEVVLLKKVSSGFSGVIRLLDWFERPDSFVLILERPEPVQDLFDFITERGALQEELARSFFWQVLEAVRHCHNCGVLHRDIKDENILIDLNRGELKLIDFGSGALLKDTVYTDFDGTRVYSPPEWIRYHRYHGRSAAVWSLGILLYDMVCGDIPFEHD------EEIIRGQVFFRQRVSSECQHLIRWCLALRPSDRPTFEEIQNHPW-MQDVLLPQETAEIHLHSLSPGPSK |
4BL1 Chain:A ((3-273)) | -----------------------------------------------------------------------------------------------------------------------KDYDELLKYYELHETIGTGGFAKVKLACHILTGEMVAIKIMDKNTL-----LP---RIKTEIEALKNLRH--QHICQLYHVLETANKIFMVLEYC-PGGELFDYIISQDRLSEEETRVVFRQIVSAVAYVHSQGYAHRDLKPENLLFD-EYHKLKLIDFGLCAK-----------SLAYAAPELIQGK---GSEADVWSMGILLYVLMCGFLPFDDDNVMALYKKIMRGKYDVPKWLSPSSILLLQQMLQVDPKKRISMKNLLNHPWIMQDYNYPVEWQSKNPFIHLDDDCV |
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General information:
TITO was launched using:
| RESULT:
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Template: 4BL1.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -158353 for 1912 contacts (-82.8/contact) +
2D Compatibility (PS) -26123 + (NN) -17156 + (LL) 3880
1D Compatibility (HY) -24400 + (ID) 4500
Total energy: -226652.0 ( -118.54 by residue)
QMean score : 0.440
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