Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MHLFCFG-YGYVARFLSKKLLSLSWKVSGTSRNQD--------------VHNTNFFNYDKVN--KDTFQ--DVTHVLVSIPPDGD-----D-------ALERYGHY-----FQ-NTKWLGYLSAASVYGDHAGN----------------WVKEESETKPIESRGKSRLRAEKKWLN----SKLPVHIFRLTGIYGPGRNV-----LVDLQ----L-----N--KARNVQKEGHFFSRIHVEDISNILFSSMQNI--KPGEIYNCADD--LPATQSEVVAYAAELLNVSVPEPVEISSLPDHAQSFYLGSKKVSNIKVKRDLGISLVYPNYKVGLENLISNQQAPIERGE |
1ORR Chain:A ((2-339)) | AKLLITGGCGFLGSNLASFALSQGIDLIVFDNLSRKGATDNLHWLSSLGNFEFVHGDIRNKNDVTRLITKYMPDSCFHLAGQVAMTTSIDNPCMDFEINVGGTLNLLEAVRQYNSNCNIIYSSTNKVYGDLEQYKYNETETRYTCVDKPNGYDESTQLDFHSPYGCSKGAADQYMLDYARIFGLNTVVFRHSSMYGGRQFATYDQGWVGWFCQKAVEIKNGINKPFTISGNGKQVRDVLHAEDMISLYFTALANVSKIRGNAFNIGGTIVNSLSLLELFKLLEDYCNIDMRFTNL-P----V-RESDQRVFVADIKKITNAIDWSPKV-SAKDGVQKMYDWTSSI----- |
|
General information:
TITO was launched using:
| RESULT:
|
Template: 1ORR.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
|
3D Compatibility (PKB) -85466 for 2131 contacts (-40.1/contact) +
2D Compatibility (PS) -27975 + (NN) -7561 + (LL) 480
1D Compatibility (HY) -7600 + (ID) 1850
Total energy: -129972.0 ( -60.99 by residue)
QMean score : 0.416
|
|
|