Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKALKLYGKRDLRYEEADMPTIEEPDDVILKVKTVGICGSDISRYSKLGPYVPGM--VWGHEFSGEVIEVGSEVTDIEIGDRAAGCPALY--CGECEYCKKGEFARCRKLTVIGARHPGAYAEYIKLPAENVVKIPNELDYEAAALVEPSAVVVH-GFYHTKLQAGDDVVVVGSGNIGLLAIQWAKVFGARRVIAIDVDDKKLALAKEVGADVVINSLKEDPLEVVAAHTDGLNADLVVEAAGSPITSAQVFAYAKKGGGVVFLGIPYADVTIERFYFEKIVRSELTVWGSWNAISAPFPGKEWQTTIHFLANKQINIEPMITHRLSLAEGPEVFERIYERNEFFGKVLFFPE |
3PII Chain:A ((10-337)) | --------KEPLKIKEVEKPTISY-GEVLVRIKACGVCHTDLHAAHGDWPVKPKLPLIPGHEGVGIVEEVGPGVTHLKVGDRV-GIPWLYSACGHCDYCLSGQETLCEHQKNAGYSVDGGYAEYCRAAADYVVKIPDNLSFEEAAPIFCAGVTTYKALKVTGAKPGEWVAIYGIGGFGHVAVQYAKAMGL-NVVAVDIGDEKLELAKELGADLVVNPLKEDAAKFMKEKVGGVHAAVVTAVSKPAFQSA--YNSIRRGGACVLVGLPPEEMPIPIF---DTVLNGIKIIGSIVGTR-----KDLQEALQFAAEGKVK---TIIEVQPLEKINEVFDRML-KGQINGRVVLTLE |
|
General information:
TITO was launched using:
| RESULT:
|
Template: 3PII.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
|
3D Compatibility (PKB) -235530 for 2825 contacts (-83.4/contact) +
2D Compatibility (PS) -33574 + (NN) -3719 + (LL) 1592
1D Compatibility (HY) -24000 + (ID) 5600
Total energy: -300831.0 ( -106.49 by residue)
QMean score : 0.495
|
|
|