Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MKKIVLYGGQFNPIHTAHMIVASEVFHELQPDEFYFLPSFMSPLKKHNNFIDVQHRLTMIQMIIDELGFGDICDDEIKRGGQSYTYDTIKAFKEQHKDSELYFVIGTDQYNQLEKWYQIEYLKEMVTFVVVNRDKNSQNVENAMIAIQIPRVDISSTMIRQRVSEGKSIQVLVPKSVENYIKGEGLYEH
3MLA Chain:B ((3-190))
MRKIGIIGGTFDPPHYGHLLIANEVYHALNLEEVWFLPNQIPP-----NITSVESRLQMLELATEAEEHFSICLEELSRKGPSYTYDTMLQLTKKYPDVQFHFIIGGDMVEYLPKWYNIEALLDLVTFVGVARPGYKLRTPYPITTVEIPEFAVSSSLLRERYKEKKTCKYLLPEKVQVYIERNGLYE-
General information:
TITO was launched using:
RESULT:
Template:
3MLA.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -156882 for 1420 contacts (-110.5/contact) +
2D Compatibility (PS) -19710 + (NN) -7831 + (LL) 312
1D Compatibility (HY) -19200 + (ID) 3500
Total energy: -206811.0 ( -145.64 by residue)
QMean score : 0.666
(partial model without unconserved sides chains):
PDB file :
Tito_3MLA.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3MLA-query.scw
PDB file :
Tito_Scwrl_3MLA.pdb
: