Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MTNRKDDHIKYA----LKYQSPYNSFDDIELIHSSLPKYNVNDIDLSTHFAGQSFEFPFYINAMTGGSEKGKAVNHKLAQVAQATGIVMATGSYSAALKNDE-DDSYPTT-DLYPDLKLATNIGLDK-----PLPAAESTVKAMNPIFLQVHVNVMQELLMPEGEREFHMWR-SHLKEYVDNIQCPLILKEVGFGMDLQSIKDAYDIGITTVDISGRGGTSFAYIE--------NQRGRDRSYLNTWGQTTAQSLINAQSMMDKMDILASGGIRHPLDMVKCLVLGAKAVGLSRTVLELVERYPVDDVIAILNSWKE---DLRMIMCALNCKKITDLRQVNYILYGQLKEANAK |
3B06 Chain:A ((4-349)) | IVNRKVEHVEIAAFENVDGLSSSTFLNDVILVHQGFPGISFSEINTKTKFFRKEISVPVMVTGMTGGRNELGRINKIIAEVAEKFGIPMGVGSQRVAIEKAEARESFAIVRKVAPTIPIIANLGMPQLVKGYGLKEFQDAIQMIEADAIAVHLNPAQEVFQPEGEPEYQIYALEKLRDISKELSVPIIVKESGNGISMETAKLLYSYGIKNFDTSGQGGTNWIAIEMIRDIRRGNWKAESAKNFLDWGVPTAASIMEVRYSVPDSFLVGSGGIRSGLDAAKAIALGADIAGMALPVL----KSAIEGKESLEQFFRKIIFELKAAMMLTGSKDVDALKKTSIVILGKLKEWAEY |
|
General information:
TITO was launched using:
| RESULT:
|
Template: 3B06.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
|
3D Compatibility (PKB) -191797 for 2932 contacts (-65.4/contact) +
2D Compatibility (PS) -34738 + (NN) -10706 + (LL) 576
1D Compatibility (HY) -20000 + (ID) 4550
Total energy: -261215.0 ( -89.09 by residue)
QMean score : 0.453
|
|
|