Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MCPCPHSQAQGETDGEAEWHNAALDFTHAMSYGDYLKLDKVLDAQFPLS-----PDHNEMLFIIQHQTSELWMKLMLHELRAAR-----EHVKSGKLGPALKMLARVSRIFDQLVHAWAVLATMTPTEYNTIRPYLGQSSGFQSYQYREIEFILGNKNATLLKPHAHRAELLA------ALEQALHTPSLYDEAIR-LMAAQGLPVS--------QERLAR--DAAAGTCYEASVEAA----------WRQVYQA----------------------------------PERYWDLYQLAEKLIDLEDSFRQWRFRHVTTVERIIGFKP-GTGGTEGVGYLRSMLDTILFPELWRLRSNL |
4HKA Chain:A ((6-319)) | -------------------------------YGEYLMLDKLLDAQCMLSEEDKRPVHDEHLFIITHQAYELWFKQIIFEFDSIRDMLDAEVIDETKTLEIVKRLNRVVLILKLLVDQVPILETMTPLDFMDFRKYLAPASGFQSLQFRLIENKLGVLTEQRVRYNQKYSDVFSDEEARNSIRNSEKDPSLLELVQRWLERTPGLEESGFNFWAKFQESVDRFLEAQVQSAMEEPVEKAKNYRLMDIEKRREVYRSIFDPAVHDALVRRGDRRFSHRALQGAIMITFYRDEPRFSQPHQLLTLLMDIDSLITKWRYNHVIMVQRMIGSQQLGTGGSSGYQYLRSTL--------------- |
|
General information:
TITO was launched using:
| RESULT:
|
Template: 4HKA.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
|
3D Compatibility (PKB) -72927 for 1460 contacts (-50.0/contact) +
2D Compatibility (PS) -26708 + (NN) -17579 + (LL) 2816
1D Compatibility (HY) -20000 + (ID) 4900
Total energy: -139298.0 ( -95.41 by residue)
QMean score : 0.393
|
|
|