Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MLFAMIGSGGFIAPKHLQAIRD--TGHFLDCSFDVHDSV-GVLDEYFPQSEFFTNIEDFEKHLEQSKAMGKEINYLSVCTPTHTHFDHIRFGLRNGMHVICEKPLVLDPSEIQELKDLEVKY-QKRVFSLLPLRLHCDTLALKEKIKSELDKNPEKVFDITLTYISVQGKWYFSSWRADVNRSGGLATQMGVNIFDTLLYLFGG-VKDKVINR-----------EEPDCVCGILFLEHAKI-RWFFSINPEHMG---VAKEKVYHKMILE--------------GEE--------VNLTQSFDNLYIESYKQILAQGGF--GLDDAAASIKLAYELRNLSLSEPNDDSHALCCKNKTDQ |
3CEA Chain:A ((9-343)) | LRAAIIGLG-RLGERHARHLVNKIQGVKLVAACALDSNQLEWAKNELGVETTYTNYKDMID--------TENIDAIFIVAPTPFHPEMTIYAMNAGLNVFCEKPLGLDFNEVDEMAKVIKSHPNQIFQSGFMRRYDDSYRYAKKIVDNGDI---GKIIYMRGYGIDPISGMESFTKFATEADSGGIFVDMNIHDIDLIRWFTGQDPVQAYGLTSNIAAPQLADIGEFETGVAQLKMSDGVIATLIGGRHAAHGNQVELEVMGSNGWVRIGEHPDLNRVTVFNDQGVVRPSLQSFGERFDTAFTDEVQDFVNNVIVGKQPEVTVDDGIKALKIAKACQQSANIGKLVDIQL--------- |
|
General information:
TITO was launched using:
| RESULT:
|
Template: 3CEA.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
|
3D Compatibility (PKB) -161484 for 2396 contacts (-67.4/contact) +
2D Compatibility (PS) -31235 + (NN) -5410 + (LL) 1000
1D Compatibility (HY) -4800 + (ID) 2400
Total energy: -204329.0 ( -85.28 by residue)
QMean score : 0.465
|
|
|