Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MSAIDKLVKASHL-IDMNDIIREGNPTLRKVAEEVTFPLSEKEEILGEKMMQFLKHSQDPIMAEKLGLRGGVGLAAPQLDISKRIIAVLVPNVEDAQGNPPKEAYSLQEVMYNPKVVSHSVQDAALSDGEGCLSVDREVPGYVVRHARVTIEYFDKTGEKHRLKLKGYNSIVVQHEIDHIDGIMFYDRINEKNPFAVKEGLLILE
3CMD Chain:B ((3-196))
------LVPGRHMMITMDDIIREGNPTLREVAKEVSLPLSEEDISLGKEMLEFLKNSQDPIKAEELHLRGGVGLAAPQLDISKRIIAVHVPS-------------SLSTVMYNPKILSHSVQDACLGEGEGCLSVDREVPGYVVRHAKITVSYYDMNGEKHKIRLKNYESIVVQHEIDHINGVMFYDHINDQNPFALKEGVLVIE
General information:
TITO was launched using:
RESULT:
Template:
3CMD.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -89680 for 1417 contacts (-63.3/contact) +
2D Compatibility (PS) -19595 + (NN) -3701 + (LL) 872
1D Compatibility (HY) -25200 + (ID) 6650
Total energy: -143954.0 ( -101.59 by residue)
QMean score : 0.489
(partial model without unconserved sides chains):
PDB file :
Tito_3CMD.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3CMD-query.scw
PDB file :
Tito_Scwrl_3CMD.pdb
: