Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MGDKIAVIPGTFDPITNGHLDIIERAAKIFDVLYVSVLNNSSKKPLFTIEERMEMIRQVTAHLPNVQVESASGLTVDYAATRGATAIVRGLRAVSDFEYEMQIASMNRTLNADIETFFVMTNTKYSFLSSSMVKEVAQYQGDISELVPEIVNKAVQAKFK
3NBA Chain:B ((24-176))
-----AVCPGSFDPVTLGHVDIFERAAAQFDEVVVAILVNPAKTGMFDLDERIAMVKESTTHLPNLRVQVGHGLVVDFVRSCGMTAIVKGLRTGTDFEYELQMAQMNKHI-AGVDTFFVATAPRYSFVSSSLAKEVAMLGGDVSELLPEPVNRRLRDRL-
General information:
TITO was launched using:
RESULT:
Template:
3NBA.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -97364 for 1154 contacts (-84.4/contact) +
2D Compatibility (PS) -16648 + (NN) -7895 + (LL) 212
1D Compatibility (HY) -17200 + (ID) 3900
Total energy: -142795.0 ( -123.74 by residue)
QMean score : 0.559
(partial model without unconserved sides chains):
PDB file :
Tito_3NBA.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3NBA-query.scw
PDB file :
Tito_Scwrl_3NBA.pdb
: