BMRB: 5292

1H Chemical Shift Assignments for TC5b

Authors

Neidigh, J.W., Fesinmeyer, R.MATTHEW., Andersen, N.H.

Assembly

Trp-cage Construct 5b

Entity

1. Trp-cage Construct 5b (polymer, Thiol state: not present), 20 monomers, 2169.396 Da Detail

NLYIQWLKDG GPSSGRPPPS

Formula weight

2169.396 Da

Exptl. method

NMR

Refine. method

Simulated annealing from random structures followed by steepest descent minimization

Data set

assigned_chemical_shifts

Chem. Shift Complete1

Sequence coverage: 100.0 %, Completeness: 99.2 %, Completeness (bb): 97.4 % Detail

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Polymer type: polypeptide(L)

	Total	1H
All	99.2 % (124 of 125)	99.2 % (124 of 125)
Backbone	97.4 % (38 of 39)	97.4 % (38 of 39)
Sidechain	100.0 % (86 of 86)	100.0 % (86 of 86)
Aromatic	100.0 % (10 of 10)	100.0 % (10 of 10)
Methyl	100.0 % (6 of 6)	100.0 % (6 of 6)

1. Trp-cage Construct 5b

NLYIQWLKDG GPSSGRPPPS

Show sample condition

Sample

Temperature 282 (±2) K, pH 7 (±0.5)

#	Name	Isotope labeling	Type	Concentration
1	Trp-cage Construct 5b			1.0 ~ 1.8 mM
2	phosphate buffer			15 mM
3	H2O			100 %

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Chem. Shift Complete2

Sequence coverage: 100.0 %, Completeness: 99.2 %, Completeness (bb): 97.4 % Detail

Download

• NMR-STAR v3.1 (partial)
• BMRB/XML (partial)
• CSV
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Polymer type: polypeptide(L)

	Total	1H
All	99.2 % (248 of 250)	99.2 % (248 of 250)
Backbone	97.4 % (76 of 78)	97.4 % (76 of 78)
Sidechain	100.0 % (172 of 172)	100.0 % (172 of 172)
Aromatic	100.0 % (20 of 20)	100.0 % (20 of 20)
Methyl	100.0 % (12 of 12)	100.0 % (12 of 12)

1. Trp-cage Construct 5b

NLYIQWLKDG GPSSGRPPPS

Show sample condition

Sample

Temperature 280 (±2) K, pH 7 (±1.0)

#	Name	Isotope labeling	Type	Concentration
4	Trp-cage Construct 5b			1.0 ~ 1.8 mM
5	phosphate buffer			15 mM
6	Trifluoroethanol			30 %
7	H2O			70 %

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Protein Blocks Logo

Calculated from 38 models in PDB: 1L2Y, Strand ID: A Detail

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Release date

2002-06-12

Citation

Designing a 20-residue protein
Neidigh, J.W., Fesinmeyer, R.MATTHEW., Andersen, N.H.
Nat. Struct. Biol. (2002), 9, 425-430, PubMed 11979279 , DOI 10.1038/nsb798 , Abstract

Related entities 1. Trp-cage Construct 5b, : 1 : 2 : 25 entities Detail

Experiments performed 2 experiments Detail