Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MAKAKFQRTKPHVNIGTIGHVDHGKTTLTAAITKVLHDKFPDLNETKAFDQIDNAPEERQRGITINIAHVE-----------YQTDK------------RHYAHVDAPGHADYIKNMITGAAQMDGAILVVAATD-GPMPQTREHVLLARQVGVPYILVALNKADAVDDEELLELVEMEVRELLAAQEFDEDAPVVRVSALKALEGDAKWVASVEELMNAVDESIPDPVRETDKPFLMPVEDVFTITGRGT-----VVTGRVERGVINVNEEVEI-----------VGIRPSTTKTTVTGVEMFRKLLDQGQAGDNVGL---LLRGVKREDVERGQVVTKPGTTTPHTEFEGQVYILSKDEGGRHTPFFNNYRPQFYFRTTDVTGVVTLPEGTEMVMPGDNTNISVKLIQPVAMDEGLRFAIREGGRTVGAGRVTKIIK |
1KK1 Chain:A ((6-322)) | -------SRQAEVNIGMVGHVDHGKTTLTKALTGVW---------------TD--SEELRRGITIKIGFADAEIRRCPNCGRYSTSPVCPYCGHETEFVRRVSFIDAPGHEALMTTMLAGASLMDGAILVIAANEPCPRPQTREHLMALQIIGQKNIIIAQNKIELVDKEKALENYR-QIKEFIEGT-VAENAPIIPISALHG--------ANIDVLVKAIEDFIPTPKRDPNKPPKMLVLRSFDVNKPG-KLVGGVLDGSIVQGKLKVGDEIEIRPGVPYEEHGRIKYEPITTE--IVSLQAGGQFVEEAYPGGLVGVGTKLDPYLTKGDLMAGNVVGKPGKLPP--------------------------------------------------------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 1KK1.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -108882 for 2128 contacts (-51.2/contact) +
2D Compatibility (PS) -29250 + (NN) -13593 + (LL) 7740
1D Compatibility (HY) -20800 + (ID) 5300
Total energy: -170085.0 ( -79.93 by residue)
QMean score : 0.490
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