Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MPRYALITGASSGIGLALAEALARRGRALILVARQRDALESIAYELAQRFGVEVLFRTCDLSEPLQLSGLLHELEQGERQIDLLVNNAGIGTSGPFI---DQEWAREQELIELNILALARLCHSLGARMAAQGGGQILNIASVAAFQPGAWMSNYYASKAYVLHFSEGLREELKERGVKVSVLCPGPTRTAFFREAGMRLGRLDRSKLMMTPEEVALLALRGLDKNRALIVPGWRNRLLALSPRLAPRWLVRRLAARINASAVPSAPRG
3AI2 Chain:C ((8-188))
--KVAVITGSSSGIGLAIAEGFAKEGAHIVLVARQVDRLHEAARSLKEKFGVRVLEVAVDVATPEGVDAVVESVRSSFGGADILVNNAGTGSNETIMEAADEKW---QFYWELHVMAAVRLARGLVPGMRARGGGAIIHNASICAVQPLWYEPIYNVTKAALMMFSKTLATEVIKDNIRVNCINPGLILTPDWIKTAKELTKDNGGDWKGYLQSVADEHAPIKRFASPEELANFFVFLCSERATYSVGSAYFVDGGMLKTL--------
General information:
TITO was launched using:
RESULT:
Template:
3AI2.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -128834 for 1499 contacts (-85.9/contact) +
2D Compatibility (PS) -19825 + (NN) -12737 + (LL) 988
1D Compatibility (HY) -15600 + (ID) 3450
Total energy: -179458.0 ( -119.72 by residue)
QMean score : 0.657
(partial model without unconserved sides chains):
PDB file :
Tito_3AI2.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3AI2-query.scw
PDB file :
Tito_Scwrl_3AI2.pdb
: