Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MANEPAIGAIDRLQRSSRDVTTLPAVISRWLSSVLPGG-A---APEVTVESGVDSTGMSSETIILTARWQQD-GRSIQQKLVARVAPAAEDVPVFPTYRLDHQFEVIRLVGELTDVPVPRVRWIETTGDVLGTPFFLMDYVEGVVPPDVMPYTFGDNWFADAPAERQRQLQDATVAALATLHSIPNAQNTFSFLTQGRTSDTTLHRHFNWVRSWYDFAVE---G------IGRSPLLERTFEWLQSHWPDDAAAREPVLLWGDARVGNVLYRDF------QPVAVLDWEMVALGPRELDVAWMIFAHRVFQELAGLA----TLPGLPEVMREDDVRATYQALTGVE----------------LGDLHWFYVYSGVMWACVFMRTGARRVHFGEIEKPDDVESLFYHAGLMKHLLGEEH |
4DA5 Chain:A ((82-429)) | -----------------QPEPRTRRRAYLWCKEFLPGAWRGLREDEFHIS--VIRGGLSNMLFQCSLPDTTATLGDEPRKVLLRLY----------AEAMVLESVMFAILAER-SL-GPKLYGIFP-------QGRLEQFIPSRRLDTEE-----------L---SLPDISAEIAEKMATFHGMKMPFNKEPK---------WLFGTMEKYLKEVLRIKFTEESRIKKLHKLLSYNLPLELENLRSLLEST--PSPVVFCHNDCQEGNILLLEGRENSEKQKLMLIDFEYSSYNYRGFDIGNHFCEWMYDYSYEKYPFFRANIRKYPTKKQQLHFISSYLPAFQNDFENLSTEEKSIIKEEMLLEVNRFALASHFLWGLWSIVQAK-------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 4DA5.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -178679 for 2028 contacts (-88.1/contact) +
2D Compatibility (PS) -29579 + (NN) -6565 + (LL) 4324
1D Compatibility (HY) -10000 + (ID) 2000
Total energy: -222499.0 ( -109.71 by residue)
QMean score : 0.335
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