Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MGKGSMTAHATPNEPDYPPPPGGPPPPADIGRLLLRCHDRPGIIAAVSTFLARAGANIISLDQHSTAPEGGTFLQRAIFHLPGLTAAVDELQRDFGSTVADKFGIDYRFAEAAKPKRVAIMASTEDHCLLDLLWRNRRGELEMSVVMVIANHPD--LAAHVRPFGVPFIHIPATR-DTRTEAEQRQLQLLS-GNVDLVVLARYMQILSPGFLEAIGCPLINIHHSFLPAFTGAAPYQRARERGVKLIGATAHYVTEVLDEGPIIEQDVVRVDHTHTVDDLVRVGADVERAVLSRAVLWHCQDRVIVHHNQTIVF
3P9X Chain:A ((3-192))
-------------------------------------------------------------------------------------------------------------------KRVAIFASGSGTNAEAIIQSQKAGQLPCEVALLITDKPGAKVVERVKVHEIPVCALDPKTYPSKEAYEIEVVQQLKEKQIDFVVLAGYMRLVGPTLLGAYEGRIVNIHPSLLPAFPGLHAIEQAIRANVKVTGVTIHYVDEGMDTGPIIAQEAVSIEEEDTLETLTTKIQAVEHRLYPATLHKLLSKAEN---------
General information:
TITO was launched using:
RESULT:
Template:
3P9X.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -155767 for 1409 contacts (-110.6/contact) +
2D Compatibility (PS) -20301 + (NN) -11864 + (LL) 5516
1D Compatibility (HY) -14800 + (ID) 2800
Total energy: -200016.0 ( -141.96 by residue)
QMean score : 0.600
(partial model without unconserved sides chains):
PDB file :
Tito_3P9X.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3P9X-query.scw
PDB file :
Tito_Scwrl_3P9X.pdb
: