Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MIIFVWAQDRAGNIGKDNKMPWHLPGDLQFFKKTTTGKTLVMGRKTYESLGKALPNRKTIVLTRDQGLKLDDAEILHSKEAVLALAETGEPIYIVGGAEIYRLFMDVADQLIVTKIDAEFEADTAFPEVDWENFSEVAKEFHEKDEKNKYNYTFYTYERN
3JW3 Chain:B ((9-166))
-VSFMVAMDENRVIGKDNNLPWRLPSELQYVKKTTMGHPLIMGRKNYEAIGRPLPGRRNIIVTRNEGYHVEGCEVAHSVEEVFELCKNEEEIFIIGGAQIYDLFLPYVDKLYITKIHHAFEGDTFFPEMDMTNWKEVFVEKGLTDEKNPYTYYYHVYEK-
General information:
TITO was launched using:
RESULT:
Template:
3JW3.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -92815 for 1139 contacts (-81.5/contact) +
2D Compatibility (PS) -16947 + (NN) -5611 + (LL) 128
1D Compatibility (HY) -18400 + (ID) 3750
Total energy: -137395.0 ( -120.63 by residue)
QMean score : 0.633
(partial model without unconserved sides chains):
PDB file :
Tito_3JW3.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3JW3-query.scw
PDB file :
Tito_Scwrl_3JW3.pdb
: