Job name:

6CAA chain A

5aa8a05c-47bf-41cd-8f59-e0ce116b9d82
Finished
Show only modeled chain
Models Number of gaps:3 Gap lengths: 56, 23, 12
Model Entanglement Average DOPE-HR (by gap length)
DOPE-HR 1st gap2nd gap3rd gap
Model 1 Non-trivial -124264
Model 2 Non-trivial -126316
Model 3 Non-trivial -125531
Model 4 Non-trivial -125390
Model 5 Non-trivial -124241
Reload
Warning: All models are renumbered - the first residue in the structure has index 1.
Mix & match
None of the models is perfect? By clicking the button below you can download a .pdb file with the currently shown mix of models - for each gap at most one model can be selected. If none of them is checked, the gap will be left as is. Fourth and further gaps (sorted by size) can only come from one of the models.
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 4131 109-356 356-395 -- --
Model 2 Slipknot S 4131 113-357 357-564 -- --
Model 3 Slipknot S 4131 111-356 356-564 -- --
Model 4 Slipknot S 4131 114-356 356-564 -- --
Model 5 Slipknot S 4131 113-355 355-564 -- --
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


4YZF

A

S +31,31,31

44.42%

93.97%

35.79%

1.34

..Target: GLIKDIKRKAPFFASDFYDALNIQALSAILFIYLATVTNAITFGGLLGDATDNMQGVLESFLGTAVSGAIFCLFAGQPLTILSSTGPVLVFERLLFNFSKDNNFDYLEFRLWIGLWSAFLCLILVATDASFLVQYFTRFTEEGFSSLISFIFIYDAFKKMIKLADYYPINSNFKVGYNTLFSCTCVPPDPANISISNDTTLAPEYLPTMSSTDMYHNTTFDWAFLSKKECSKYGGNLVGNNCNFVPDITLMSFILFLGTYTSSMALKKFKTSPYFPTTARKLISDFAIILSILIFCVIDALV-GVDTPKLIVPSEFKPTSPNRGWFVPPFG---ENPWWVCLAAAIPALLVTILIFMDQQITAVIVNRKEHKLKKGAGYHLDLFWVAILMVICSLMALPWYVAATVISIAHIDSLKMETETSAPGEQPKFLGVREQRVTGTLVFILTGLSVFMAPILKFIPMPVLYGVFLYMGVASLNGVQFMDRLKLLLMPLKHQPDFIYLRHVPLRRVHLFTFLQVLCLALLWILKSTVAAIIFPVMILALVAVRKG-MDYLFSQHDLSFLDDVIPEK
Template: GLVRDIRRRYPYYLSDITDAFSPQVLAAVIFIYFAALSPAITFGGLLGEKTRNQMGVSELLISTAVQGILFALLGAQPLLVVGFSGPLLVFEEAFFSFCETNGLEYIVGRVWIGFWLILLVVLVVAFEGSFLVRFISRYTQEIFSFLISLIFIYETFSKLIKIFQDHPLQKTY-------------LPNTALLSL----------------------------------------------------------VLMAGTFFFAMMLRKFKNSSYFPGKLRRVIGDFGVPISILIMVLVDFFIQDTYTQKLSVPDGFKV-------VIHPLGLRSEFPIWMMFASALPALLVFILIFLESQITTLIVSKPERKMVKGSGFHLDLLLVVGMGGVAALFGMPWLSATTVRSVTHANALTVM-----------IQEVKEQRISGLLVAVLVGLSILMEPILSRIPLAVLFGIFLYMGVTSLSGIQLFDRILLLFKPPKYHPDVPYVKRVKTWRMHLFTGIQIICLAVLWVVKSTPASLALPFVLILTVPLRRVLLPLIFRNVELQCL------D

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

LFSCTCVPPDPANISISNDTTLAPEYLPTMSSTDMYHNTTFDWAFLSKKECSKYGGNLVGNN

4YZF A S +31,31,31 5.36% 16.07%

-------LPNTALLSL----------------------------------------------

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

IVPSEFKPTSPNRGWFVPPFG---ENPWWVCL

4YZF A S +31,31,31 30.43% 69.57%

SVPDGFKV-------VIHPLGLRSEFPIWMMF

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

KMETETSAPGEQPKFLGV

4YZF A S +31,31,31 0.00% 8.33%

TVM-----------IQEV


Fri Mar 30 14:28:47 2018	JOB CREATED : 5aa8a05c-47bf-41cd-8f59-e0ce116b9d82
Fri Mar 30 14:29:02 2018	STATUS CHANGED : N -> R
Fri Mar 30 14:29:02 2018	INFO : JOB STARTED AT: 2018-03-30 14:29:02.491131
Fri Mar 30 14:29:02 2018	INFO : METHOD: 1
Fri Mar 30 14:29:02 2018	INFO : Building Profile...
Fri Mar 30 14:29:02 2018	INFO : --E-value set to 0.001--
Fri Mar 30 14:53:29 2018	INFO : Homologue pool found...
Fri Mar 30 14:53:29 2018	INFO : Verifying structure sequences of homologues...
Fri Mar 30 14:53:42 2018	INFO : Starting homologue filtering...
Fri Mar 30 14:53:57 2018	INFO : Getting structures from PDB...
Fri Mar 30 14:54:05 2018	INFO : Creating modelling alignment...
Fri Mar 30 14:54:05 2018	INFO : Adding other chains
Fri Mar 30 14:54:05 2018	INFO : Modelling...
Fri Mar 30 16:45:50 2018	INFO : Model 1 built
Fri Mar 30 16:45:50 2018	INFO : Validating Calpha distances...
Fri Mar 30 16:45:50 2018	INFO : Model 1 distances correct: True
Fri Mar 30 16:45:50 2018	INFO : Modelling...
Fri Mar 30 18:33:57 2018	INFO : Model 2 built
Fri Mar 30 18:33:57 2018	INFO : Validating Calpha distances...
Fri Mar 30 18:33:57 2018	INFO : Model 2 distances correct: True
Fri Mar 30 18:33:57 2018	INFO : Modelling...
Fri Mar 30 19:48:10 2018	INFO : Model 3 built
Fri Mar 30 19:48:10 2018	INFO : Validating Calpha distances...
Fri Mar 30 19:48:10 2018	INFO : Model 3 distances correct: True
Fri Mar 30 19:48:10 2018	INFO : Modelling...
Fri Mar 30 21:03:52 2018	INFO : Model 4 built
Fri Mar 30 21:03:52 2018	INFO : Validating Calpha distances...
Fri Mar 30 21:03:52 2018	INFO : Model 4 distances correct: True
Fri Mar 30 21:03:52 2018	INFO : Modelling...
Fri Mar 30 21:57:01 2018	INFO : Model 5 built
Fri Mar 30 21:57:01 2018	INFO : Validating Calpha distances...
Fri Mar 30 21:57:01 2018	INFO : Model 5 distances correct: True
Fri Mar 30 21:58:21 2018	INFO : Finished modelling
Fri Mar 30 21:58:21 2018	STATUS CHANGED : R -> P
Fri Mar 30 21:58:22 2018	INFO : Finished edm surfaces: no map
Fri Mar 30 21:58:22 2018	INFO : Checking topology...
Fri Mar 30 22:15:10 2018	INFO : Knot matrices done...
Fri Mar 30 22:17:05 2018	INFO : Some knots found!
Fri Mar 30 22:17:05 2018	INFO : No lassos found...
Fri Mar 30 22:17:05 2018	INFO : Finishing...
Fri Mar 30 22:17:06 2018	INFO : Job done
Fri Mar 30 22:17:06 2018	STATUS CHANGED : P -> F
Fri Mar 30 22:17:06 2018	STATUS CHANGED : F -> F

GapRepairer | Interdisciplinary Laboratory of Biological Systems Modelling