Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MG-GFMQYSQRLGEA---GRNDRRSMRGAFRPGL---LPTLVVLGLLPVLLWLGTWQLQRADEKRALLAS-------------YEARRGAEPVSPGQLEGLRD-----PAYVRVRL----HGRFDERHTLLLDNRLRNGQAGVEVLQPF--------------------YDQASGLWLLVNRGWVAWTDRRSPPT----------LETPDRVLLLDAWTYLPPPGG-------------LHLADAPAGGWP------RLVTQLDIPALWQAFGRAGLPWEIRLEPGDASFDTDWPLVSM-----PPERHTGYAVQ-----------WFALATALLALYLYLG---------------VRRAREKNHESRDSDA------ |
3ES5 Chain:A ((42-420)) | MRLGWIDPLPQVDTIFPLGLEPNVESIPAGEVELDFNLPETIAKPFADTVTSVGDRIQLVDDDKENIATSIYGLSFFKAARQLYSTMLDHEKAVNQPLKAVYYDETPIPAHMSGALGIIGHMKTKVGDVLVKDAGVLFKRGTAAGVTKFSEIDNDKTWNLDCSKLVWADHSSLSMIKRLASEKISQLVKQRYRVTDAQGHVYSVSMPQLTDQALPDYYDSIPDVAPNSDQLRVLTAALQMSLAQFRNDELPHDEDRSDLLTTLDLLYADGAYEISALRDQFELLMARYTTDFKWRVESIFKVGPPPAGTTGYGAQTVSSTGNTARWQFPLSDADINIGYLFSPSKSFSLFPKMVGYSKRAREDASASFANSDAKKFYAD |
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General information:
TITO was launched using:
| RESULT:
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Template: 3ES5.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -47143 for 1513 contacts (-31.2/contact) +
2D Compatibility (PS) -27478 + (NN) -5377 + (LL) 0
1D Compatibility (HY) -4800 + (ID) 2700
Total energy: -87498.0 ( -57.83 by residue)
QMean score : 0.000
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