Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)



Input alignment information:
Query sequenceMVSALLKFDFSVVRHNMAIKLNNNFLIIMGTSFLLLLAYHIKKEGKEVLSSLFVISNFFDNSTLFFVIIVVMRVVAGTFGGRPLKTLDGKTTRPTTDKVKGAIFN-MIGPFFEGGRVLDLFSGSGSLAIEAISRG-MDQAVLVEKDRRAQVVIQENIAMT-KSPEQFQLLKM-EANRALEQLTGQFDLVLLDPPYAKEEIVKQIQIMDSKGLLGDDIMIVCETDKSVDLPEEIASFGIWKQKIYGISKVTVYVR--------
2ESR Chain:A ((18-177))--------------------------------------------------------------------------------------------------VRGAIFNMIG-PYFNGGRVLDLFAGSGGLAIEAVSRGMS-AAVLVEKNRKAQAIIQDNI--IMTKAENRFTLLKMEAERAIDCLTGRFDLVFLDPPYAKETIVATIEALAAKNLLSEQVMVVCETDKTVLLPKEIATLGIWKEKIYGISKVTVYVNEGHHHHHH


General information:
TITO was launched using:
RESULT:

Template: 2ESR.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -95013 for 1161 contacts (-81.8/contact) +
2D Compatibility (PS) -16297 + (NN) -7268 + (LL) 7892
1D Compatibility (HY) -18000 + (ID) 4800
Total energy: -133486.0 ( -114.98 by residue)
QMean score : 0.665

(partial model without unconserved sides chains):
PDB file : Tito_2ESR.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-2ESR-query.scw
PDB file : Tito_Scwrl_2ESR.pdb: