Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MKALVLGGSGSIGSEIVKQLLTDGFEVYVQYYRTD-INELTSKFNDDKVRFIQADLSQTIDIDKTFG-----DIKSLDCLIYASGQSLYGVLQDMKDHDIDACYQLNVLQLIRLCRYFVDVLRQSANGRIIVISSIWGETGASMETIYSAMKSAQLGFVKALSQELALTSVTVNAIAPGFVAGNMASEWQEDELQAMITELPQQRLVLPSEVAHTCAYLYHSNARSVTGTIQKVNGAWYI
3ENN Chain:A ((8-244))
-KALVTGATGGLGEAIARALHAQGAIVGLHGTREEKLKELAAELGE-RIFVFPANLSDREAV-KALGQKAEEEMGGVDILVNNAGITRDGLFVRMSDEDWDAVLTVNLTSVFNLTRELTHPMMRRRNGRIINITSIVGVTGNPGQANYCASKAGLIGFSKSLAQEIASRNVTVNCIAPGFIES--------KQKDAIMGNIPMKRMGVGADIAAAVVYLASDEAAYVTGQTLHVNGGMAM
General information:
TITO was launched using:
RESULT:
Template:
3ENN.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -199804 for 1929 contacts (-103.6/contact) +
2D Compatibility (PS) -23617 + (NN) -3550 + (LL) 784
1D Compatibility (HY) -14000 + (ID) 3700
Total energy: -243887.0 ( -126.43 by residue)
QMean score : 0.566
(partial model without unconserved sides chains):
PDB file :
Tito_3ENN.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3ENN-query.scw
PDB file :
Tito_Scwrl_3ENN.pdb
: