Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MENFLYQLEIKTLGQVFTPKNIVDF---MLILKH-----NHGSVLEPSAGDGSFLKRL---------KKAVGIEIDPKICP-------------------KNALCMDFFDYPL--ENQFNTIIGNPPYVKHKDIAPSTKEKLH--Y-------SLFDERSNLYLFFIEKAIKHLKPKGELIFITPRDFLKS--TSSVKLNEWIYKEGTITHFFELGDQKIFPNAMPNCVIFRFCKGDFSRITN------D-----GLQF-----------------------V---CK---KGILYF--LN----Q--------SYTQKL-SEVFKVKVGAV--SGCDK-IFKNETYG-------------NLEFVTSI-TKRTNV------LEKMVFVN--------------KP--NDYLLQH------------KDSLMQRKIKKFNENNWFEWGRMHHISPKKRIYVNAKT-HQKNPFFIHQCPNYDGSILALFPYNQNLDLQNLCDKLNA-INWQELGFVC---DGRFLFSQRSLENALLPKDFLN |
3S1S Chain:A ((289-807)) | -------RGRGHEGVVPTDIELGKVLSIISQHILGRPLTEDEVISDPAAGSGNLLATVSAGFNNVMPRQIWANDIETLFLELLSIRLGLLFPQLVSSNNAPTITGEDVCSLNPEDFANVSVVVMNPPYVSGVTDPAIKRKFAHKIIQLTGNRPQTLFGQIGVEALFLELVTELVQDGTVISAIMPKQYLTAQGNESKAFREFLVGNFGLEHIFLYPREGLFEEVIKDTVVFVGRKGSSVEEIEVLDSFTPLEQVDLHNLKRALSNSSNEQIIQPMGMELRKEKREELENRVTVGWRHITSNGRVAEEWITNNLESHCIRLVASDYDLRRGRVGNKGASDLLFINSKKKLWDLLDESVPRDWLYPALRKVNEINTPIFNEDATPVRFLCPPNSAYQDGTGESIILDKILDVYVDFQVYKSKQKKFEKSKEELKEI---LYKESDFYSSE--------HTVFIPRALRRSARAFINEQKVFCSTNALEVFGGN-SEEMWLLLSWLSSVFAQLQFEAMAKDQEGERKLEKKSIQNLYIPNLGDI |
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General information:
TITO was launched using:
| RESULT:
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Template: 3S1S.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -96003 for 2567 contacts (-37.4/contact) +
2D Compatibility (PS) -37997 + (NN) -12448 + (LL) 1700
1D Compatibility (HY) -12800 + (ID) 2700
Total energy: -160248.0 ( -62.43 by residue)
QMean score : 0.322
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