Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKTVEHFVTKFVPENYNLFLDINRQTKTFSGNVAVSGEALDNNISFHQKGLTIKSVLLDNQPLDFQLDEDNEAMHIQLHETGSMVLVFEFSGHITDNMTGMYPSYYTVNGIKKEVISTQFESHFAREVFPSIDEPEAKATFDLSLKFDQKEGEIALSNMPEINAEQR-QETGLWT---FDTTPKMSSYLLAFALGELHGKTTHTKNGTLVGSYA-----TKAHQLNELDFSLDIVVRVIEFYEDYFGVRYPIPQSLHVALPDFSAGAMENWGLVTYREVYLLVD-ENSSVSSRQQVALVVAHEIAHQWFGNLVTMKWWDDLWLNESFANMMEYVSIDYIEPKLNIFEDFQTGGLPLALKRDATDGVQSVHV------EVNHPDEINTLFDPAIVYAKGSRLMHMLRRWLGDTDFAAGLKIYFEKHQYQNTIGRDLWNAL-----SQTSGK---DVAAFMDSWLEQPGYPVMAAKIEEDELILTQKQFFIGEHEDKSR------LWQIPLNSNWEGIPEILTEETVVIPNFSQLAE---KNKENGALRFNTENTAHYITNY---QGQLLEH-IISDLPLMDNISKLQIVQERHLLAESGMISYSSLIPLVSLLSQETSYLVNSAIKSVIDGLSLFVQEDSQDEFDFKEFVNKLSAFNFNRLGFEKREGEGDDSEMVRHLSLSLALYSDNEHAIEEAHHIFKA--------HENNIAAIPAAIRLLVLTNEMKH-------FESKELSHLLLETYSTTTDGNFKRQLASALSHTTDSKTLKKLLSDWKNKDIVKPQDLAMSWYATFLKNSFTQQSVWEWAQENWEWI-KATLGGDMSFDKFVIYPSSSFKTEERLEQYKNFFEPQLSDMAI---SRNISMGIKEISARVLLITKQKEEVINTIKKYI |
4NAQ Chain:A ((113-894)) | ----------------------------------------------------------------------------------------EFQGELADDLAGFYRSEYMEGNVKKVLATTQMQSTDARKSFPCFDEPAMKATFNITLI--HPNNLTALSNMPPKGSSTPLAEDPNWSVTEFETTPVMSTYLLAYIVSEFQSVNETAQNGVLIRIWARPNAIAEGHGM----YALNVTGPILNFFANHYNTSYPLPKSDQIALPDFNAGAMENWGLVTYRENALLFDPQSSSISNKERVVTVIAHQLAHQWFGNLVTLAWWNDLWLNEGFASYVEYLGADHAEPTWNLKDLIVPGDVYRVM---AVDALASSHPLTTPAEEVNTPAQISEMFD-SISYSKGASVIRMLSNFLTEDLFKEGLASYLHAFAYQNTTYLDLWEHLQKAVDAQTSIRLPDTVRAIMDRWTLQMGFPVITVDTKTGN--ISQKHFLLDSESNVTRSSAFDYLWIVPISSIKNGV----MQDHYWLRDVSQAQNDLFKTASDDWVLLNVNVTGYFQVNYDEDNWRMIQHQLQTNLSVIPVINRAQVIYDSFNLATAHMVPVTLALDNTLFLNGEKEYMPWQAALSSLSYFSLMF-DRSEVYGPMKKYLRKQVEPLFQHFETLTKNWTERPENLMDQYSEINAISTACSNGLPQCENLAKTLFDQWMSDPENN--PIHPNLRSTIYCNAIAQGGQDQWDFAWGQLQQAQLV--------NEADKLRSALACSNEVWLLNRYLGYTLNPDLIRKQD-ATSTINSIASNVIGQPLAWDFVQSNWKKLFQDYGGGSFSFSNLIQGVTRRFSSEFELQQLEQFKKNNM-DVGFGSGTRALEQALEKTKANIKWVKENKEVVLNWFIEHS |
|
General information:
TITO was launched using:
| RESULT:
|
Template: 4NAQ.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
|
3D Compatibility (PKB) -224047 for 6034 contacts (-37.1/contact) +
2D Compatibility (PS) -76575 + (NN) -24704 + (LL) 7604
1D Compatibility (HY) -51200 + (ID) 11700
Total energy: -380622.0 ( -63.08 by residue)
QMean score : 0.383
|
|
|