Job name:

3ET3 chain A

dc9a5ca6-57b4-4746-8bcf-8f2a2cc7fab6
Finished
Electron density map:

Differential EDM:
Models Number of gaps:1 Gap lengths: 13
Model Entanglement Average DOPE-HR (by gap length)
DOPE-HR 1st gap
Model 1 Unknot -39291
Model 2 Err -39285
Model 3 Err -39028
Model 4 Err -38994
Model 5 Err -38994
Reload
Warning: All models are renumbered - the first residue in the structure has index 1.
Mix & match
Provided protein had only one gap - thus there are no gap-filling combinations to be made.

Pro Tip: Since you provided a structure that contains some crystallographic information you can verify our models using the wwPDB service.
Validity report for the RCSB PDB structure you were repairing can be accessed here
DOPE (Discrete Optimized Protein Energy) score per residue. The lower the score, the better.
Since DOPE is calculated against the neighbours of a given amino acid, the scores
can vary between unmoved segments of different models. See here for more information.
PDB
code
Chain Entanglement
type
Seq
identity
Total gap
coverage
Total gap
identity
RMSD [Å] Pairwise alignment to the target: gap


3ADU

B

Unknot

100.00%

100.00%

100.00%

0.77

..Target: MESADLRALAKHLYDSYIKSFPLTKAKARAILTGKTTDKSPFVIYDMNSLMMGEDKIKFKHITPLQEQSKEVAIRIFQGCQFRSVEAVQEITEYAKSIPGFVNLDLNDQVTLLKYGVHEIIYTMLASLMNKDGVLISEGQGFMTREFLKSLRKPFGDFMEPKFEFAVKFNALELDDSDLAIFIAVIILSGDRPGLLNVKPIEDIQDNLLQALELQLKLNHPESSQLFAKLLQKMTDLRQIVTEHVQLLQVIKKTETDMSLHPLLQEIYKDLY
Template: -ESADLRALAKHLYDSYIKSFPLTKAKARAILTG----KSPFVIYDMNSLMMGEDKIKFKHITPLQEQSKEVAIRIFQGCQFRSVEAVQEITEYAKSIPGFVNLDLNDQVTLLKYGVHEIIYTMLASLMNKDGVLISEGQGFMTREFLKSLRKPFGDFMEPKFEFAVKFNALELDDSDLAIFIAVIILSGDRPGLLNVKPIEDIQDNLLQALELQLKLNHPESSQLFAKLLQKMTDLRQIVTEHVQLLQVIKKTET--SLHPLLQEI----Y

PDB
code
Chain Knot
type
Gap
coverage
Gap
identity
>Target_Sequence: gap

DKIKFKHITPLQEQSKEVA

3ADU B Unknot 100.00% 100.00%

DKIKFKHITPLQEQSKEVA


Tue Jun 25 15:20:52 2019	JOB CREATED : dc9a5ca6-57b4-4746-8bcf-8f2a2cc7fab6
Tue Jun 25 15:21:02 2019	STATUS CHANGED : N -> R
Tue Jun 25 15:21:02 2019	INFO : JOB STARTED AT: 2019-06-25 15:21:02.480601
Tue Jun 25 15:21:02 2019	INFO : METHOD: 1
Tue Jun 25 15:21:02 2019	INFO : Building Profile...
Tue Jun 25 15:21:02 2019	INFO : --E-value set to 0.001--
Tue Jun 25 15:30:34 2019	INFO : Homologue pool found...
Tue Jun 25 15:30:34 2019	INFO : Verifying structure sequences of homologues...
Tue Jun 25 16:35:29 2019	INFO : Starting homologue filtering...
Tue Jun 25 16:37:37 2019	INFO : Getting structures from PDB...
Tue Jun 25 16:37:41 2019	INFO : Creating modelling alignment...
Tue Jun 25 16:37:41 2019	INFO : Modelling...
Tue Jun 25 16:39:11 2019	INFO : Model 1 built
Tue Jun 25 16:39:11 2019	INFO : Validating Calpha distances...
Tue Jun 25 16:39:11 2019	INFO : Model 1 distances correct: True
Tue Jun 25 16:39:11 2019	INFO : Modelling...
Tue Jun 25 16:40:39 2019	INFO : Model 2 built
Tue Jun 25 16:40:39 2019	INFO : Validating Calpha distances...
Tue Jun 25 16:40:39 2019	INFO : Model 2 distances correct: True
Tue Jun 25 16:40:39 2019	INFO : Modelling...
Tue Jun 25 16:42:06 2019	INFO : Model 3 built
Tue Jun 25 16:42:06 2019	INFO : Validating Calpha distances...
Tue Jun 25 16:42:06 2019	INFO : Model 3 distances correct: True
Tue Jun 25 16:42:06 2019	INFO : Modelling...
Tue Jun 25 16:43:34 2019	INFO : Model 4 built
Tue Jun 25 16:43:34 2019	INFO : Validating Calpha distances...
Tue Jun 25 16:43:34 2019	INFO : Model 4 distances correct: True
Tue Jun 25 16:43:34 2019	INFO : Modelling...
Tue Jun 25 16:45:01 2019	INFO : Model 5 built
Tue Jun 25 16:45:01 2019	INFO : Validating Calpha distances...
Tue Jun 25 16:45:01 2019	INFO : Model 5 distances correct: True
Tue Jun 25 16:45:20 2019	INFO : Finished modelling
Tue Jun 25 16:45:20 2019	STATUS CHANGED : R -> P
Tue Jun 25 16:45:30 2019	INFO : Finished edm surfaces: success
Tue Jun 25 16:45:30 2019	INFO : Checking topology...
Tue Jun 25 16:45:31 2019	INFO : Knot matrices done...
Tue Jun 25 16:45:31 2019	INFO : No knots found...
Tue Jun 25 16:45:31 2019	INFO : No lassos found...
Tue Jun 25 16:45:31 2019	INFO : Finishing...
Tue Jun 25 16:45:31 2019	INFO : Job done
Tue Jun 25 16:45:31 2019	STATUS CHANGED : P -> F
Tue Jun 25 16:45:31 2019	STATUS CHANGED : F -> F

GapRepairer | Interdisciplinary Laboratory of Biological Systems Modelling