Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MDWENCSSLTDFFLLGITNNPEMKVTLFAVFLAVYIINFSANLGMIVLIRMDYQLHTPMYFFLSHLSFCDLCYSTATGPKMLVDLLAKNKSIPF------------YGCALQFLVFCIFADSECLLLSVMAFDRYKAIINPLLYTVNMSSRVCYLLLTGVYLVGIADALIHMTLAFRLC---FCGSNEINHFFCDIPPLLLLSRSDTQVNELVLFTVFG--FIELSTISGVFI---SYCYIILSVLEIHSAEGRFKALSTCTSHLSA---VAIFQGTLL-----------FMYFRPSSSYSLDQDKMTSLFYTLVVPMLNPLIYSLRNKDVKEALKKLKNKILF |
3REY Chain:A ((52-302)) | -----------------------------------------------------------------------------------DILVGVLAIPFAITISTGFCAACHGCLFIACFVLVLAQSSIFSLLAIAIDRYIAIAIPLRYNGLVTGTRAAGIIAICWVLSFAIGLTPM-LGWNNCGQPGCGEGQVACLFEDVVPM----------NYMVYFNFFACVLVPLLLMLGVYLRIFAAARRQLKQMESQPLPGE-RARSTLQKEVHAAKSAAIIAGLFALCWLPLHIINCFTFFCPDCSHAPLWLMYLAIVLAHTNSVVNPFIYAYRIREFRQTFRKIIRS--- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3REY.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -143831 for 1309 contacts (-109.9/contact) +
2D Compatibility (PS) -21104 + (NN) -3291 + (LL) 7904
1D Compatibility (HY) -18000 + (ID) 2800
Total energy: -181122.0 ( -138.37 by residue)
QMean score : 0.112
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