Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MAEWKTDTEEVKKVVGRCREFKRSLQEEKCSPFIKDLDSYALKIIVERRKTEMQLEKAIGELKKAKSNEDDAKVALRVLQGASVVSWIWPPARIAATAAIVAAEAVLKFMKEDTEKCKRNVELLERMLEIYSNQAKASANLMNQAWEGIKKRLHFYTDKHQEFIRRLKQASDAIDNEYNFPTPGVLLEYDFERPAISYTPKKSVFNERLKDLRENFSASLYADLKDKIHHNALSNDDLERMIAFREQEFEKSLEDWMGAYSYDENPNDELDRMAISKEQELEKSLEDLMPSVLGVPSYNESLTLAKNRCVKNFKEALEGFTEKIKESPNDSNAINEAFDNLETELERATENLSQKIDPVLERNENYTQKALEYREFLESRKESFIVDEKNPYPEEVSFNEWRWAEFDSVFSAIVPLEDLNKTACAHHALKALQATLKDNDLGFDATELEQIAKGFIPRGYLWHFDANVLGNLALVREELLLGVKHTKGYSLWTEFLQKQN |
3HOT Chain:A ((5-345)) | ----VPNKEQTRTVLIFCFHLKKT---------AAESHRMLVEAFGEQVPTVKTCERWFQRFKSGDFDVDDKEHG--------------------KPPKRYEDAELQALLDEDDAQTQKQLAEQ-----------------LEVSQQAVSNRLREMGKIQK-----------------------------------VGRWVPHELNERQMERRKNTCEILLSRYKRK--------SFLHRIVTGDEKWIFFVNPKRKKSYVDPGQPAT--------STARPNRFGKKTMLCVWWDQSGVIYYELLK------------------PGETVNAARYQQQLINLNRALQRKRPEYQHRV--IFLHDNAPSHTARAVRDTLETLNWEVL-----PHAAYS--------------------PDLA--PSDYHLFASMGHALAEQRFD-SYESVKKWLDEWFAA-----KDDEFYWRGIHKLPERWEKCVASDGKYFE-------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3HOT.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -8104 for 2248 contacts (-3.6/contact) +
2D Compatibility (PS) -35191 + (NN) -8338 + (LL) 12468
1D Compatibility (HY) -6400 + (ID) 2400
Total energy: -47965.0 ( -21.34 by residue)
QMean score : 0.279
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