Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MTDKIFQEKVGPVALTIVPTQKYKSNKIVFKFRAPLERETVTKRALLSILLETNSEKYPTQTDFRKQLANLYGANFYTTTAKKGNEHVLTVIFDMIDGQYVSDGNHILEDAFAFMEQALFRPNVANDAFNEETLTREKENLKSSLEGIYDDKIRFASKRLVEEMFRDDEFRFGSAGVLEDIDAITAKDLYEYYLQFIAEDTIEIFICGDVTKEEVMPLIEKMAFSPRPERKGIF-YTKEAPKEV--RVIHEQQAINQGKLVLGYQTETLFGDDDFVALQLANGLLGGFANSKIFINVREKASLAYYASSRIDSFK--GYMIISAGIDEVNYEQALKIIEEQVVAMKQGNFTDDELNQTKEMLINQLLETNDQAQGLIEL-VYNNVLRDANLDLENWIAKIKQATKEEV--VAAINKIKPDTIYFLSKGGEELHGKNHI |
3HDI Chain:A ((108-406)) | -----------------------------------------------------------------------------------------------------------------------------HSTFQKEELEKERKVVFEEIKMVDDTPDDIVHDLLSSATYGKHSLGYPILGTVETLNSFNEGMLRHYMDRFYTGDYVVISVAGNVHDE----LIDKIKETFSQVKPTTYNYQGEKPMFLPNRIVRKKET-EQAHLCLGYPGLPI-GDKDVYALVLLNNVLGGSMSSRLFQDIREKRGLCYSVFSYHSSFRDSGMLTIYAGTGHDQLDDLVYSIQETTSALAEKGLTEKELENGKEQLKGSLMLSLESTNSRMSRNGKNELLLKKHRSLDEMIEQINAVQKQDVSRLAKILLSASPSISLINANGE-------- |
|
General information:
TITO was launched using:
| RESULT:
|
Template: 3HDI.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
|
3D Compatibility (PKB) -57850 for 2051 contacts (-28.2/contact) +
2D Compatibility (PS) -31760 + (NN) -19256 + (LL) 10668
1D Compatibility (HY) -16800 + (ID) 3700
Total energy: -118698.0 ( -57.87 by residue)
QMean score : 0.417
|
|
|