Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MIMKKKILAYALSALTCGLFTSCSDWLDINHDPNTAEK-VDPGYLFNYVAVNWAGTRTGGDFYIPLSMSSQCQVDGGLDYGGWDESVYTISPYSTGNTWKHYYSVGGN--NLMLAIKNAEEADPVNHNAIAQCKILLAEHMYEATMLWGDIPFTESWNGTIKYPKFDSQESVLNGVLSLLDEALQIMDLNDANAIDE--YDIYYKGDMNKWMTLAKSLKFRTLMVMVDKDPSKATAIGTLLQAG--GMVSSASDNLVFPYSAEPGNQNPKYELIELVGGTQI-LFFASNY---MLKPMQERN----------------------DPRIPCYFEPGA-DGVYRGLGNREPAVTDDK--DNML-SSVVSSYL-----FRKDAPELIYSCQEQLLLEAEAYARGLGVAQNLSKANELYKKGIREACAFYGVAEADIDTYVTG---------LPELTALT-QEKALYEIHMQQWIDLMDR-PFEEFVQWRRSGTAGNEVPTLQ--VPEDATSKEL------IRRWEYSPEEMTANINAPKES--------PKIWEKLWFDL |
3P1U Chain:A ((15-520)) | --------------------------------------NMNEPRLASTLRGGLIIEGNVEQRLKPLQIDFYSQMTVDGGG--WGTKNYIQDDEWNNLVWEEYLKQIASINIVIRSLTEKDK--DAYANTIAFARIWRVYVHTLAADKFGPMPFPAYEIV-EANPPYKSLKDIYDEYFRELDAAINGFNDSAQPIFSDAGIDLIYKNDVSKWKRFANSLRLRLAVRLTEVDQEKCIAEANAAISSPAGLISDKADNAYMPPKADGSWGQD-YNYTM-FQITWSGPICMSKSVEKLVTNIGGVAWPQGVVNQTSGVAVSSVHPEKVDPRAPKIFQPGIENGDWKGLVYGPKAEEANTGIYQSKQCAELG-FIIKDGYPYKSRPYDLFLSEEVHFLKAELYARGFIA----GDAKSEYEAGVRASFATWGVTSE-VDDYLTSTEKNEAGTSARYDDQQGAGNTALEKIITQKYIAGIPDLAQEGWNDKRRLNLPRLDVAVYRDQAVYNNNDKDILKSANFIKRMRYPTKESLINATEYEKGKSMLGGKGDIVSTPLWWDK |
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General information:
TITO was launched using:
| RESULT:
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Template: 3P1U.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -92284 for 3683 contacts (-25.1/contact) +
2D Compatibility (PS) -45487 + (NN) -14804 + (LL) 3024
1D Compatibility (HY) -9200 + (ID) 4600
Total energy: -163351.0 ( -44.35 by residue)
QMean score : 0.287
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