Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MNGFIAFME-KYFIPYAAKIGGQRHLVAIRD-GFITTMPLMILGS----FAVLINNFPIPAYQKFMNNLFGEGTWQAFGGNVWNGTFAILALLIAFTVAYNLAKSY-DKDPLSSAVVSVATFFTIGAIAPGADGIANTGGLGSTGLFLALIIAILSTEIFT---RLSGSPKLIINMPDGV-------PPAVSRSFAAL------FPAMITV-------SIFGLITAFFQAAGVTNLVISFYELVQE------PFMGLANSLPAALLLAFVSAFLWFFGLHGANIIDPFM-------------------------------------QTINIPAIEANVKA-LEAG------KELPYIVNKPFFDSFVNLGGTGATIGLIIAIFIVARKHKAYMTVSKLSAAPGIFNINEPMMFGLP-IVLNPIMFIPYILAPL-VL------VTVAYFATAIGWVPACT-IVTPWTTPPIIGGALATQSIAGGVLAAVNLGLSILIFLP-----FAKIAQIQELRREKEALAAEGVTAE |
4C0E Chain:A ((9-528)) | LEAAHLLEQMEYVFDEWIHLCNNPHATERAAMIFVHQLHSVQLVTNRDEFLLFLRHALDKSVERFEQGIHSGASIAES----FQAVEALVKLIIIFVKSHSAAVAFMD------------SILALGVLVANSHHVKRGENFNQRVFYRFFALLLHEVGLLAGHFSKSHYEQIILNFAARLFDMRPNLLPGFACAWAGLVSHRAFLPVILGLPDEKGWAPFTKLLEQFLGCVGELVKTFTVSSLGKEMYHAALKILIVLQHDFPIYLDKFRVQLCQSLPLHATQLVNLILAAIPPNCNSLADPFQAGLKVDKIPDMKERPPTAFDSAGLLREAGLLDILERMLQNGPSEDGVAQINHAINKSTSFGYVPLGVNRRLIDAVVARFAEFAINRASS-----RSDSAIFVAGANDIKTLQMLVTEVSPEARYYLVSSMVNELRYPNAYTNYFSQALLDIFGHDMSDPEENLVREQIVRVLLERVLGYWPQPWGLIITILELLKNDKYLFFELPFIKATPEVAERFTALARSAA |
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General information:
TITO was launched using:
| RESULT:
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Template: 4C0E.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -303997 for 2862 contacts (-106.2/contact) +
2D Compatibility (PS) -42643 + (NN) -3459 + (LL) 1028
1D Compatibility (HY) -19200 + (ID) 3000
Total energy: -371271.0 ( -129.72 by residue)
QMean score : 0.196
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