BMRB: 5273

1H chemical shift assignments for SGCI[L30R, K31M]

Authors

Gaspari, Z., Patthy, A., Graf, L., Patthy, A.

Assembly

Schistocerca gregaria chymotrypsin inhibitor variant L30R,K31M

Entity

1. Schistocerca gregaria chymotrypsin inhibitor variant L30R,K31M (polymer, Thiol state: all disulfide bound), 35 monomers, 3700.185 Da Detail

EVTCEPGTTF KDKCNTCRCG SDGKSAACTR MACPQ

Formula weight

3700.185 Da

Entity Connection

disulfide 3 Detail

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ID	Type	Value order	Atom ID 1	Atom ID 2
1	disulfide	sing	1:CYS17:SG	1:CYS28:SG
2	disulfide	sing	1:CYS14:SG	1:CYS33:SG
3	disulfide	sing	1:CYS4:SG	1:CYS19:SG

Source organism

Schistocerca gregaria

Exptl. method

NMR

Refine. method

simulated annealing

Data set

assigned_chemical_shifts

Chem. Shift Complete

Sequence coverage: 94.3 %, Completeness: 86.6 %, Completeness (bb): 94.4 % Detail

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Polymer type: polypeptide(L)

	Total	1H
All	86.6 % (162 of 187)	86.6 % (162 of 187)
Backbone	94.4 % (67 of 71)	94.4 % (67 of 71)
Sidechain	81.9 % (95 of 116)	81.9 % (95 of 116)
Aromatic	60.0 % (3 of 5)	60.0 % (3 of 5)
Methyl	90.0 % (9 of 10)	90.0 % (9 of 10)

1. Schistocerca gregaria chymotrypsin inhibitor

EVTCEPGTTF KDKCNTCRCG SDGKSAACTR MACPQ

Show sample condition

Sample

Temperature 292 (±1) K, pH 3.0 (±0.2)

#	Name	Isotope labeling	Type	Concentration
1	Schistocerca gregaria chymotrypsin inhibitor			2.8 mM

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Protein Blocks Logo

Calculated from 10 models in PDB: 1KIO, Strand ID: A Detail

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Release date

2002-02-04

Citation

Comparative structure analysis of proteinase inhibitors from the desert locust, Schistocerca gregaria
Gaspari, Z., Patthy, A., Graf, L., Patthy, A.
Eur. J. Biochem. (2002), 269, 527-537, PubMed 11856311 , DOI: , Abstract

Related entities 1. Schistocerca gregaria chymotrypsin inhibitor variant L30R,K31M, : 1 : 3 : 36 entities Detail

Experiments performed 2 experiments Detail