BMRB Entry 4997

Name: 1H, 13C Chemical Shift Assignment of PT-insulin in H2O and 35% TFE
Published: 2001-05-21

Chem Shift validation: AVS_anomalous, AVS_full
BMRB Entry DOI: doi:10.13018/BMR4997

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Bioinformatics (2015) 31 (8): 1322-1324 doi:10.1093/bioinformatics/btu829

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Title: 1H, 13C Chemical Shift Assignment of PT-insulin in H2O and 35% TFE PubMed: 11524020

Deposition date: 2001-04-23 Original release date: 2001-05-21

Authors: Keller, Danielle; Clausen, R.; Josefsen, Knud; Led, Jens

Citation: Keller, Danielle; Clausen, R.; Josefsen, Knud; Led, Jens. "Flexibility and Bioactivity of Insulin: an NMR Investigation of the Solution Structure and Folding of an Unusually Flexible Human Insulin Mutant with Increased Biological Activity" Biochemistry 40, 10732-10740 (2001).

Assembly members:
Insulin, polymer, 21 residues, Formula weight is not available
Insulin, polymer, 30 residues, Formula weight is not available

Natural source: Common Name: human Taxonomy ID: 9606 Superkingdom: Eukaryota Kingdom: Metazoa Genus/species: Homo sapiens

Experimental source: Production method: recombinant technology Host organism: Pichia pastoris

Entity Sequences (FASTA):
Insulin: GIVEQCCTSICSLYQLENYC N
Insulin: FVNQHLCGSHLVEALYLVCG ERGFFYPTKT

Data sets:

assigned_chemical_shifts
- CS_1
- CS_2
- CS_3
- CS_4

Data type	Count
13C chemical shifts	109
1H chemical shifts	546

Additional metadata:

Assembly
Samples and Experiments
Software
Spectrometers
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Entity Assembly ID	Entity Name	Entity ID
1	PT-insulin A chain	1
2	PT-insulin B chain	2

Name	Sample	Sample state	Sample conditions
COSY with DQF	not available	not available	not available
TOCSY/NOESY with WaterGate	not available	not available	not available
HSQC: Gradient enhanced	not available	not available	not available

Related Database Links:

BMRB	1000 1002 1004 1006 1008 1010 1012 1014 1016 1018 1020 1022 1023 11016 1344 15464 1585 1587 1632 1761 4266 554 556 6203 6204 6205 936 994 996 998
PDB	1A7F 1AI0 1AIY 1B17 1B18 1B19 1B2A 1B2B 1B2C 1B2D 1B2E 1B2F 1B2G 1B9E 1BEN 1BZV 1DEI 1EFE 1EV3 1EV6 1EVR 1FU2 1FUB 1G7A 1GUJ 1HIQ 1HIS 1HIT 1HLS 1HTV 1HUI 1IZA 1IZB 1JCO 1LPH 1M5A 1MHJ 1MPJ 1OS3 1OS4 1QIY 1QIZ 1QJ0 1SDB 1SF1 1SJT 1SJU 1T1K 1T1P 1T1Q 1TRZ 1TYL 1TYM 1UZ9 1W8P 1WAV 1XDA 1XGL 1ZEG 1ZEH 1ZEI 1ZNI 1ZNJ 2AIY 2C8Q 2C8R 2CEU 2G4M 2H67 2HH4 2HHO 2HIU 2JMN 2JV1 2OLY 2OLZ 2OM0 2OM1 2OMG 2OMH 2OMI 2QIU 2TCI 3AIY 3BXQ 3MTH 4AIY 4INS 5AIY 6INS 7INS 9INS 1JCO
EMBL	CAA23424 CAA23475 CAA23828 CAA43403 CAA43405
GenBank	AAA17540 AAA19033 AAA36849 AAA59172 AAA59173
PRF	0601246A 1006230A 550086A 560164B 580107B 640291A
REF	NP_000198 NP_001008996 NP_001075804 NP_001103242 NP_001123565
SWISS-PROT	P01308 P01311 P01315 P01321 P30406

1	PHE	VAL	ASN	GLN	HIS	LEU	CYS	GLY	SER	HIS
2	LEU	VAL	GLU	ALA	LEU	TYR	LEU	VAL	CYS	GLY
3	GLU	ARG	GLY	PHE	PHE	TYR	PRO	THR	LYS	THR

Biological Magnetic Resonance Data Bank

BMRB Entry 4997

Title: 1H, 13C Chemical Shift Assignment of PT-insulin in H2O and 35% TFE PubMed: 11524020

Additional metadata:

Assembly:

Entities:

Samples:

Experiments:

Software:

NMR spectrometers:

Related Database Links:

1	PHE	VAL	ASN	GLN	HIS	LEU	CYS	GLY	SER	HIS
2	LEU	VAL	GLU	ALA	LEU	TYR	LEU	VAL	CYS	GLY
3	GLU	ARG	GLY	PHE	PHE	TYR	PRO	THR	LYS	THR

1	PHE	VAL	ASN	GLN	HIS	LEU	CYS	GLY	SER	HIS
2	LEU	VAL	GLU	ALA	LEU	TYR	LEU	VAL	CYS	GLY
3	GLU	ARG	GLY	PHE	PHE	TYR	PRO	THR	LYS	THR

1	PHE	VAL	ASN	GLN	HIS	LEU	CYS	GLY	SER	HIS
2	LEU	VAL	GLU	ALA	LEU	TYR	LEU	VAL	CYS	GLY
3	GLU	ARG	GLY	PHE	PHE	TYR	PRO	THR	LYS	THR