Job name:

2NWL chain A

1a6ac975-742a-41ca-a21c-b1e5929c6cb4
Finished
Electron density map:

Differential EDM:
Models Number of gaps:1 Gap lengths: 6
Model Entanglement Average DOPE-HR (by gap length)
DOPE-HR 1st gap
Model 1 Non-trivial -58367
Model 2 Non-trivial -58180
Model 3 Non-trivial -58409
Model 4 Non-trivial -58044
Model 5 Non-trivial -57912
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
EntanglementHelpKnotProtLassoProtLinkProt
Model Type Knot core Slipknot Lasso Piercing Show
range loop range loop position in JSmol
Model 1 Slipknot S 31 49-355 355-371 -- --
Model 2 Slipknot S 31 52-355 355-371 -- --
Model 3 Slipknot S 31 48-352 352-371 -- --
Model 4 Slipknot S 31 52-356 356-371 -- --
Model 5 Slipknot S 31 52-357 357-371 -- --
None
Topologies marked by an OK sign () are in accordance with the template topology.
Warning: Entanglement type is assigned automatically - for more complicated topologies there may be some disagreements with manually curated databases.
Model 1
Model 2
Model 3
Model 4
Model 5
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


2NWW

A

S +31,+31

99.75%

100.00%

100.00%

0.68

..Target: YPVLIKILIGLILGAIVGLILGHYGYAHAVHTYVKPFGDLFVRLLKMLVMPIVFASLVVGAASISPARLGRVGVKIVVYYLLTSAFAVTLGIIMARLFNPGAGIHLAVGGQQFQPHQAPPLVHILLDIVPTNPFGALANGQVLPTIFFAIILGIAITYLMNSENEKVRKSAETLLDAINGLAEAMYKIVNGVMQYAPIGVFALIAYVMAEQGVHVVGELAKVTAAVYVGLTLQILLVYFVLLKIYGIDPISFIKHAKDAMLTAFVTRSSSGTLPVTMRVAKEMGISEGIYSFTLPLGATINMDGTALYQGVCTFFIANALGSHLTVGQQLTIVLTAVLASIGTAGVPGAGAIMLAMVLHSVGLPLTDPNVAAAYAMILGIDAILDMGRTMVNVTGDLTGTAIVAKTE
Template: YPVLQKILIGLILGAIVGLILGHYGYAHAVHTYVKPFGDLFVRLLKMLVMPIVFASLVVGAASISPARLGRVGVKIVVYYLLTSAFAVTLGIIMARLFNPGAGIHLAVGGQQFQPHQAPPLVHILLDIVPTNPFGALANGQVLPTIFFAIILGIAITYLMNSENEKVRKSAETLLDAINGLAEAMYKIVNGVMQYAPIGVFALIAYVMAEQGVHVVGELAKVTAAVYVGLTLQILLVYFVLLKIYGIDPISFIKHAKDAMLTAFVTRSSSGTLPVTMRVAKEMGISEGIYSFTLPLGATINMDGTALYQGVCTFFIANALGSHLTVGQQLTIVLTAVLASIGTAGVPGAGAIMLAMVLHSVGLPLTDPNVAAAYAMILGIDAILDMGRTMVNVTGDLTGTAIVAKTE

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

QQFQPHQAPPLV

2NWW A S +31,+31 100.00% 100.00%

QQFQPHQAPPLV


Tue Oct 15 12:27:41 2019	JOB CREATED : 1a6ac975-742a-41ca-a21c-b1e5929c6cb4
Tue Oct 15 12:28:02 2019	STATUS CHANGED : N -> R
Tue Oct 15 12:28:02 2019	INFO : JOB STARTED AT: 2019-10-15 12:28:02.298691
Tue Oct 15 12:28:02 2019	INFO : METHOD: 1
Tue Oct 15 12:28:02 2019	INFO : Precalculated profile found...
Tue Oct 15 12:28:02 2019	INFO : Homologue pool found...
Tue Oct 15 12:28:02 2019	INFO : Verifying structure sequences of homologues...
Tue Oct 15 12:30:21 2019	INFO : Starting homologue filtering...
Tue Oct 15 12:30:45 2019	INFO : Getting structures from PDB...
Tue Oct 15 12:30:51 2019	INFO : Creating modelling alignment...
Tue Oct 15 12:30:51 2019	INFO : Modelling...
Tue Oct 15 12:47:56 2019	INFO : Model 1 built
Tue Oct 15 12:47:56 2019	INFO : Validating Calpha distances...
Tue Oct 15 12:47:56 2019	INFO : Model 1 distances correct: True
Tue Oct 15 12:47:56 2019	INFO : Modelling...
Tue Oct 15 12:55:21 2019	INFO : Model 2 built
Tue Oct 15 12:55:21 2019	INFO : Validating Calpha distances...
Tue Oct 15 12:55:21 2019	INFO : Model 2 distances correct: True
Tue Oct 15 12:55:21 2019	INFO : Modelling...
Tue Oct 15 13:12:14 2019	INFO : Model 3 built
Tue Oct 15 13:12:14 2019	INFO : Validating Calpha distances...
Tue Oct 15 13:12:14 2019	INFO : Model 3 distances correct: True
Tue Oct 15 13:12:14 2019	INFO : Modelling...
Tue Oct 15 13:19:46 2019	INFO : Model 4 built
Tue Oct 15 13:19:46 2019	INFO : Validating Calpha distances...
Tue Oct 15 13:19:46 2019	INFO : Model 4 distances correct: True
Tue Oct 15 13:19:46 2019	INFO : Modelling...
Tue Oct 15 13:26:49 2019	INFO : Model 5 built
Tue Oct 15 13:26:49 2019	INFO : Validating Calpha distances...
Tue Oct 15 13:26:49 2019	INFO : Model 5 distances correct: True
Tue Oct 15 13:27:13 2019	INFO : Finished modelling
Tue Oct 15 13:27:13 2019	STATUS CHANGED : R -> P
Tue Oct 15 13:27:27 2019	INFO : Finished edm surfaces: success
Tue Oct 15 13:27:27 2019	INFO : Checking topology...
Tue Oct 15 13:30:12 2019	INFO : Knot matrices done...
Tue Oct 15 13:31:08 2019	INFO : Some knots found!
Tue Oct 15 13:31:08 2019	INFO : No lassos found...
Tue Oct 15 13:31:08 2019	INFO : Finishing...
Tue Oct 15 13:31:09 2019	INFO : Job done
Tue Oct 15 13:31:09 2019	STATUS CHANGED : P -> F
Tue Oct 15 13:31:09 2019	STATUS CHANGED : F -> F

GapRepairer | Interdisciplinary Laboratory of Biological Systems Modelling