BMRB Entry 30708

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PDB ID: 6vgb
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR30708
MolProbity Validation Chart

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Title:
De novo designed Rossmann fold protein ROS2_36830
Deposition date:
2020-01-07
Original release date:
2020-08-14
Authors:
Pan, X.; Zhang, Y.; Kelly, M.; Kortemme, T.
Citation:

Citation: Pan, Xingjie; Thompson, Michael; Zhang, Yang; Liu, Lin; Fraser, James; Kelly, Mark; Kortemme, Tanja. "Expanding the space of protein geometries by computational design of de novo fold families"  Science 369, 1132-1136 (2020).
PubMed: 32855341

Assembly members:

Assembly members:
entity_1, polymer, 121 residues, 13953.312 Da.

Natural source:

Natural source:   Common Name: not available   Taxonomy ID: 32630   Superkingdom: not available   Kingdom: not available   Genus/species: not available not available

Experimental source:

Experimental source:   Production method: recombinant technology   Host organism: Escherichia coli

Entity Sequences (FASTA):

Entity Sequences (FASTA):
entity_1: MGSSHHHHHHSSGLVPRGSH MGLLVLIWSNDKKLIEEARK MAEKANLYLLTLETDDKKIE DILKSLGPPVKILVLLEDTK DADKVKKEIEKKARKKNLPV RIRKVTSPDEAKRWIKEFSE E

Data sets:
Data typeCount
13C chemical shifts370
15N chemical shifts101
1H chemical shifts746

Additional metadata:

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Assembly:

Entity Assembly IDEntity NameEntity ID
1unit_11

Entities:

Entity 1, unit_1 121 residues - 13953.312 Da.

1   METGLYSERSERHISHISHISHISHISHIS
2   SERSERGLYLEUVALPROARGGLYSERHIS
3   METGLYLEULEUVALLEUILETRPSERASN
4   ASPLYSLYSLEUILEGLUGLUALAARGLYS
5   METALAGLULYSALAASNLEUTYRLEULEU
6   THRLEUGLUTHRASPASPLYSLYSILEGLU
7   ASPILELEULYSSERLEUGLYPROPROVAL
8   LYSILELEUVALLEULEUGLUASPTHRLYS
9   ASPALAASPLYSVALLYSLYSGLUILEGLU
10   LYSLYSALAARGLYSLYSASNLEUPROVAL
11   ARGILEARGLYSVALTHRSERPROASPGLU
12   ALALYSARGTRPILELYSGLUPHESERGLU
13   GLU

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