Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MNPLLILTFVAAALAAPFDDDDKIVGGYNCEENSVPYQVSLNS-GYHFCGGSLINEQWVVSAGHCYKSRIQVRLGEHNIEVLEGNEQFINAAKIIRHPQYDRKTLNNDIMLIKLSSRAVINARVSTISLPTAPPATGTKCLISGWGNTASSGADYPDELQCLDAPVLSQAKCEASYPGKITSNMFCVGFLEGGKDSCQGDSGGPVVCNGQLQGVVSWGD-GCAQKNKPGVYTKVYNYVKWIKNTIAANS
2QXI Chain:A ((1-223))
-----------------------IIDGAPCARGSHPWQVALLSGNQLHCGGVLVNERWVLTAAHCKMNEYTVHLGSDTLG--DRRAQRIKASKSFRHPGYSTQTHVNDLMLVKLNSQARLSSMVKKVRLPSRCEPPGTTCTVSGWGTTTSPDVTFPSDLMCVDVKLISPQDCTKVYKDLLENSMLCAGIPDSKKNACNGDSGGPLVCRGTLQGLVSWGTFPCGQPNDPGVYTQVCKFTKWINDTMKKH-
General information:
TITO was launched using:
RESULT:
Template:
2QXI.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -127756 for 1912 contacts (-66.8/contact) +
2D Compatibility (PS) -24078 + (NN) -8722 + (LL) 2084
1D Compatibility (HY) -19600 + (ID) 4650
Total energy: -182722.0 ( -95.57 by residue)
QMean score : 0.744
(partial model without unconserved sides chains):
PDB file :
Tito_2QXI.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2QXI-query.scw
PDB file :
Tito_Scwrl_2QXI.pdb
: