Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MSDSNLSDNHLPD------TFFLTGIPGLEAA-HFWIAIPFCAMYLVALV---GNAALILVIAMDNALHAPMYLFLCLLSLTDLALSSTTVP----KMLAILWLHAGEISFGGCLAQMFCVHSIYALESSI--LLAMAFDRYVAICNPLRYTTIL--NHAVIGRIGFVGLFRSVAIVSPFIFLLRRLPYCGHRVMTHTYCEHMGIARLACANITVNIVYGLTVALLAMGLDSILIAISYGFILH-AVFHLPSHDA----QHKALSTCGSHIGIILVFYIPAFFSFLTHRFGHHEVPKHVHIFLANLYVLVPPVLNPILYGARTKEIRSRLLKLLHLGKTSI |
4LDL Chain:A ((154-463)) | --------NQTPNRAKRVITTFRTGTWDAYAADEVWVVGMGIVMSLIVLAIVFGNVLVITAIAKFERLQTVTNYFITSLACADLVMGLAVVPFGAAHILTKTW------TFGNFWCEFWTSIDVLCVTASIETLCVIAVDRYFAITSPFKYQSLLTKNKARV----IILMVWIVSGLTSFLPIQMHWYRATHQEAINCYAEE------TCCDFFTNQAYAIASSIVSFYVPLVIMVFVYSRVFQEAKRQLQ---KFALKEHKALKTLGIIMGTFTLCWLPFFIVNIVHVIQDNLIRKEVYILL-NWIGYVNSGFNPLIY-CRSPDFRIAFQELLCL----- |
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General information:
TITO was launched using:
| RESULT:
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Template: 4LDL.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -277325 for 1968 contacts (-140.9/contact) +
2D Compatibility (PS) -29152 + (NN) -10518 + (LL) 1220
1D Compatibility (HY) -23600 + (ID) 3850
Total energy: -343225.0 ( -174.40 by residue)
QMean score : 0.288
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