Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKFLHTADLHLGKIV----SGVSMLAEQEYILTQITQIAEEEQVDALILAGDL-YDRAVPPADAVKVLNDILVKWNVELGIPIFAISGNHDSAERLAFGSQWYESSKLYMKGKCTSQFDGIPFMDAEVWLVPYHEP--AIIRQAFADNSIRSF-EDAMQAVTKQIRSKWDTSKAQILVGHAFVSGGIPSDSE----RQLAIGNVDRVSTDCFDGFTYTALGHLHHPHAI-RHPSIFYSGSPLKYSFSEANDHKSVRIVELEGK-----ELISVTERFLTPKHDMRIISGTLAELTENLVENPDDFFQVNLMDEGALIDPMGKLRQFYPNILHLERK-----KQTLKETQDSFEEIMKKDDLELFGQFFEHVNGTELTETQKQKLAD-VFEQARKEDAE |
3QG5 Chain:C ((2-379)) | -KILHTSDWHLGVTSWTSSRPVDRREELKKALDKVVEEAEKREVDLILLTGDLLHSRNNPSVVALHDLLDYLKR--MMRTAPVVVLPGNHDWKGLKLFGNFVTSISSDITFVMSFEPVDVEAKRGQKVRILPFPYPDE-----NEGD--FRFFLESRLNKLYEEALKKEDFA---IFMGHFTVE------REIIINRALIPSVVD-----------YAALGHIHSFREIQKQPLTIYPGSLIRIDFGEEADEKGAVFVELKRGEPPRYERIDASPLPLKTLYYKKIDTSALKSIRDFCRNFPGYVRVVYEEDSGILPDLMGEI----DNLVKIERKSRREIEEVLRESPEEFKEEL--DKLDYFELFKEYLKKREENHEKLLKILDELLDEVKKSEA- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3QG5.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -115480 for 2472 contacts (-46.7/contact) +
2D Compatibility (PS) -35374 + (NN) -9163 + (LL) 1932
1D Compatibility (HY) -13200 + (ID) 5050
Total energy: -176335.0 ( -71.33 by residue)
QMean score : 0.443
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