Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MKKGLMISFEGPDGAGKTTVLEAVLPLLREKLSQDILTTREPGGVTISEEIRHIILDVKHTQMDKKTELLLYMAARRQHLVEKVLPALEEGKIVLMDRFIDSSVAYQGSGRGLDKSHIKWLNDYATDSHKPDLTLYFDVPSEVGLERIQKSVQREVNRLDLEQLDMHQRVRQGYLELADSEPNRIVTIDASQQLDEVIA---ETFSIILDRINQ
4GMD Chain:C ((6-212))
---GLFVTLEGPEGAGKSTNRDYLAERLRER-GIEVQLTREPGGTPLAERIRELLLAPSDEPMAADTELLLMFAARAQHLAGVIRPALARGAVVLCDRFTDATYAYQGGGRGLPEARIAALESFVQGDLRPDLTLVFDLPV-------------RLDRFEQEDRRFFEAVRQTYLQRAAQAPERYQVLDAGLPLAEVQAGLDRLLPNLLERLN-
General information:
TITO was launched using:
RESULT:
Template:
4GMD.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -68507 for 1464 contacts (-46.8/contact) +
2D Compatibility (PS) -21145 + (NN) -12458 + (LL) 1908
1D Compatibility (HY) -13600 + (ID) 4100
Total energy: -117902.0 ( -80.53 by residue)
QMean score : 0.606
(partial model without unconserved sides chains):
PDB file :
Tito_4GMD.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-4GMD-query.scw
PDB file :
Tito_Scwrl_4GMD.pdb
: