BMRB Entry 5287

Name: Backbone 1H and 15N Chemical shift assigments for [2H,15N]CaM:CaMKI(320) complex
Published: 2002-06-13

Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR5287

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Nicholas Rego and David Koes
3Dmol.js: molecular visualization with WebGL
Bioinformatics (2015) 31 (8): 1322-1324 doi:10.1093/bioinformatics/btu829

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Title:

Backbone 1H and 15N Chemical shift assigments for [2H,15N]CaM:CaMKI(320) complex

Deposition date:

2002-02-12

Original release date:

2002-06-13

Authors:

Kranz, James; Lee, Eun; Nairn, Angus; Wand, A.

Citation:

Citation: Kranz, James; Lee, Eun; Nairn, Angus; Wand, A.. "A Direct Test of the Reductionist Approach to Structural Studies of Calmodulin Activity: Relevance of Peptide Models of Target Proteins" J. Biol. Chem. 277, 16351-16354 (2002).
PubMed: 11904288

Assembly members:

Assembly members:
calmodulin, polymer, 148 residues, 16706 Da.
Ca2+/CaM-dependent (rat) protein kinase I, polymer, 340 residues, 36000 Da.

Natural source:

Natural source: Common Name: Chicken Taxonomy ID: 9031 Superkingdom: Eukaryota Kingdom: Metazoa Genus/species: Gallus gallus

Experimental source:

Experimental source: Production method: recombinant technology

Entity Sequences (FASTA):

Entity Sequences (FASTA):
calmodulin: ADQLTEEQIAEFKEAFSLFD KDGDGTITTKELGTVMRSLG QNPTEAELQDMINEVDADGN GTIDFPEFLTMMARKMKDTD SEEEIREAFRVFDKDGNGYI SAAELRHVMTNLGEKLTDEE VDEMIREADIDGDGQVNYEE FVQMMTAK
Ca2+/CaM-dependent (rat) protein kinase I: MGSSHHHHHHSSGLVPRGSH MPGAVEGPRWKQAEDIRDIY DFRDVLGTGAFSEVILAEDK RTQKLVAIKCIAKKALEGKE GSMENEIAVLHKIKHPNIVA LDDIYESGGHLYLIMQLVSG GELFDRIVEKGFYTERDASR LIFQVLDAVKYLHDLGIVHR DLKPENLLYYSLDEDSKIMI SDFGLSKMEDPGSVLSTACG TPGYVAPEVLAQKPYSKAVD CWSIGVIAYILLCGYPPFYD ENDAKLFEQILKAEYEFDSP YWDDISDSAKDFIRHLMEKD PEKRFTCEQALQHPWIAGDT ALDKNIHQSVSEQIKKNFAK SKWKQAFNATAVVRHMRKLQ

Data sets:

assigned_chemical_shifts
- shift_set_1

Data type	Count
1H chemical shifts	144
15N chemical shifts	144

Additional metadata:

Assembly
Samples and Experiments
Software
Spectrometers
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Assembly:

Entity Assembly ID	Entity Name	Entity ID
1	calmodulin	1
2	CaM-dependent kinase I (1-320)	2

Entities:

Entity 1, calmodulin 148 residues - 16706 Da.

1

ALA

ASP

GLN

LEU

THR

GLU

GLN

ILE

ALA

2

GLU

PHE

LYS

GLU

ALA

PHE

SER

LEU

PHE

ASP

3

LYS

ASP

GLY

ASP

GLY

THR

ILE

THR

LYS

4

GLU

LEU

GLY

THR

VAL

MET

ARG

SER

LEU

GLY

5

GLN

ASN

PRO

THR

GLU

ALA

GLU

LEU

GLN

ASP

6

MET

ILE

ASN

GLU

VAL

ASP

ALA

ASP

GLY

ASN

7

GLY

THR

ILE

ASP

PHE

PRO

GLU

PHE

LEU

THR

8

MET

ALA

ARG

LYS

MET

LYS

ASP

THR

ASP

9

SER

GLU

ILE

ARG

GLU

ALA

PHE

ARG

10

VAL

PHE

ASP

LYS

ASP

GLY

ASN

GLY

TYR

ILE

11

SER

ALA

GLU

LEU

ARG

HIS

VAL

MET

THR

12

ASN

LEU

GLY

GLU

LYS

LEU

THR

ASP

GLU

13

VAL

ASP

GLU

MET

ILE

ARG

GLU

ALA

ASP

ILE

14

ASP

GLY

ASP

GLY

GLN

VAL

ASN

TYR

GLU

15

PHE

VAL

GLN

MET

THR

ALA

LYS

Entity 2, CaM-dependent kinase I (1-320) 340 residues - 36000 Da.

1	MET	GLY	SER	SER	HIS	HIS	HIS	HIS	HIS	HIS
2	SER	SER	GLY	LEU	VAL	PRO	ARG	GLY	SER	HIS
3	MET	PRO	GLY	ALA	VAL	GLU	GLY	PRO	ARG	TRP
4	LYS	GLN	ALA	GLU	ASP	ILE	ARG	ASP	ILE	TYR
5	ASP	PHE	ARG	ASP	VAL	LEU	GLY	THR	GLY	ALA
6	PHE	SER	GLU	VAL	ILE	LEU	ALA	GLU	ASP	LYS
7	ARG	THR	GLN	LYS	LEU	VAL	ALA	ILE	LYS	CYS
8	ILE	ALA	LYS	LYS	ALA	LEU	GLU	GLY	LYS	GLU
9	GLY	SER	MET	GLU	ASN	GLU	ILE	ALA	VAL	LEU
10	HIS	LYS	ILE	LYS	HIS	PRO	ASN	ILE	VAL	ALA
11	LEU	ASP	ASP	ILE	TYR	GLU	SER	GLY	GLY	HIS
12	LEU	TYR	LEU	ILE	MET	GLN	LEU	VAL	SER	GLY
13	GLY	GLU	LEU	PHE	ASP	ARG	ILE	VAL	GLU	LYS
14	GLY	PHE	TYR	THR	GLU	ARG	ASP	ALA	SER	ARG
15	LEU	ILE	PHE	GLN	VAL	LEU	ASP	ALA	VAL	LYS
16	TYR	LEU	HIS	ASP	LEU	GLY	ILE	VAL	HIS	ARG
17	ASP	LEU	LYS	PRO	GLU	ASN	LEU	LEU	TYR	TYR
18	SER	LEU	ASP	GLU	ASP	SER	LYS	ILE	MET	ILE
19	SER	ASP	PHE	GLY	LEU	SER	LYS	MET	GLU	ASP
20	PRO	GLY	SER	VAL	LEU	SER	THR	ALA	CYS	GLY
21	THR	PRO	GLY	TYR	VAL	ALA	PRO	GLU	VAL	LEU
22	ALA	GLN	LYS	PRO	TYR	SER	LYS	ALA	VAL	ASP
23	CYS	TRP	SER	ILE	GLY	VAL	ILE	ALA	TYR	ILE
24	LEU	LEU	CYS	GLY	TYR	PRO	PRO	PHE	TYR	ASP
25	GLU	ASN	ASP	ALA	LYS	LEU	PHE	GLU	GLN	ILE
26	LEU	LYS	ALA	GLU	TYR	GLU	PHE	ASP	SER	PRO
27	TYR	TRP	ASP	ASP	ILE	SER	ASP	SER	ALA	LYS
28	ASP	PHE	ILE	ARG	HIS	LEU	MET	GLU	LYS	ASP
29	PRO	GLU	LYS	ARG	PHE	THR	CYS	GLU	GLN	ALA
30	LEU	GLN	HIS	PRO	TRP	ILE	ALA	GLY	ASP	THR
31	ALA	LEU	ASP	LYS	ASN	ILE	HIS	GLN	SER	VAL
32	SER	GLU	GLN	ILE	LYS	LYS	ASN	PHE	ALA	LYS
33	SER	LYS	TRP	LYS	GLN	ALA	PHE	ASN	ALA	THR
34	ALA	VAL	VAL	ARG	HIS	MET	ARG	LYS	LEU	GLN

Samples:

sample_1: calmodulin, [U-99% 2H; U-99% 15N], 1.0 mM; Ca2+/CaM-dependent (rat) protein kinase I 1.2 mM

Ex-cond_1: pH: 6.5; temperature: 303 K; ionic strength: 0.16 M

Experiments:

Name	Sample	Sample state	Sample conditions
1H-15N-TROSY-HSQC	not available	not available	not available

Software:

felix v97.0 -

NMR spectrometers:

Varian INOVA 750 MHz

PDB	1A06 4FG7 4FG8 4FG9 4FGB 1A06
DBJ	BAC40950 BAE22345 BAG37428 BAG70091 BAG70221 BAE22345 BAG37428 BAC40950
GB	AAA19670 AAA66944 AAA99458 AAH14825 AAH71177
PRF	2024225A 2024225A
REF	NP_001070336 NP_001177124 NP_001244800 NP_003647 NP_598687 XP_001095449 NP_598687 NP_604463 NP_001070336 NP_003647
SP	Q14012 Q63450 Q91YS8
TPG	DAA17160
SWISS-PROT	Q63450 Q91YS8 Q14012
GenBank	AAH71177 AAA99458 AAH14825 AAA19670 AAA66944
AlphaFold	Q14012 Q63450 Q91YS8

1	MET	GLY	SER	SER	HIS	HIS	HIS	HIS	HIS	HIS
2	SER	SER	GLY	LEU	VAL	PRO	ARG	GLY	SER	HIS
3	MET	PRO	GLY	ALA	VAL	GLU	GLY	PRO	ARG	TRP
4	LYS	GLN	ALA	GLU	ASP	ILE	ARG	ASP	ILE	TYR
5	ASP	PHE	ARG	ASP	VAL	LEU	GLY	THR	GLY	ALA
6	PHE	SER	GLU	VAL	ILE	LEU	ALA	GLU	ASP	LYS
7	ARG	THR	GLN	LYS	LEU	VAL	ALA	ILE	LYS	CYS
8	ILE	ALA	LYS	LYS	ALA	LEU	GLU	GLY	LYS	GLU
9	GLY	SER	MET	GLU	ASN	GLU	ILE	ALA	VAL	LEU
10	HIS	LYS	ILE	LYS	HIS	PRO	ASN	ILE	VAL	ALA
11	LEU	ASP	ASP	ILE	TYR	GLU	SER	GLY	GLY	HIS
12	LEU	TYR	LEU	ILE	MET	GLN	LEU	VAL	SER	GLY
13	GLY	GLU	LEU	PHE	ASP	ARG	ILE	VAL	GLU	LYS
14	GLY	PHE	TYR	THR	GLU	ARG	ASP	ALA	SER	ARG
15	LEU	ILE	PHE	GLN	VAL	LEU	ASP	ALA	VAL	LYS
16	TYR	LEU	HIS	ASP	LEU	GLY	ILE	VAL	HIS	ARG
17	ASP	LEU	LYS	PRO	GLU	ASN	LEU	LEU	TYR	TYR
18	SER	LEU	ASP	GLU	ASP	SER	LYS	ILE	MET	ILE
19	SER	ASP	PHE	GLY	LEU	SER	LYS	MET	GLU	ASP
20	PRO	GLY	SER	VAL	LEU	SER	THR	ALA	CYS	GLY
21	THR	PRO	GLY	TYR	VAL	ALA	PRO	GLU	VAL	LEU
22	ALA	GLN	LYS	PRO	TYR	SER	LYS	ALA	VAL	ASP
23	CYS	TRP	SER	ILE	GLY	VAL	ILE	ALA	TYR	ILE
24	LEU	LEU	CYS	GLY	TYR	PRO	PRO	PHE	TYR	ASP
25	GLU	ASN	ASP	ALA	LYS	LEU	PHE	GLU	GLN	ILE
26	LEU	LYS	ALA	GLU	TYR	GLU	PHE	ASP	SER	PRO
27	TYR	TRP	ASP	ASP	ILE	SER	ASP	SER	ALA	LYS
28	ASP	PHE	ILE	ARG	HIS	LEU	MET	GLU	LYS	ASP
29	PRO	GLU	LYS	ARG	PHE	THR	CYS	GLU	GLN	ALA
30	LEU	GLN	HIS	PRO	TRP	ILE	ALA	GLY	ASP	THR
31	ALA	LEU	ASP	LYS	ASN	ILE	HIS	GLN	SER	VAL
32	SER	GLU	GLN	ILE	LYS	LYS	ASN	PHE	ALA	LYS
33	SER	LYS	TRP	LYS	GLN	ALA	PHE	ASN	ALA	THR
34	ALA	VAL	VAL	ARG	HIS	MET	ARG	LYS	LEU	GLN

1	MET	GLY	SER	SER	HIS	HIS	HIS	HIS	HIS	HIS
2	SER	SER	GLY	LEU	VAL	PRO	ARG	GLY	SER	HIS
3	MET	PRO	GLY	ALA	VAL	GLU	GLY	PRO	ARG	TRP
4	LYS	GLN	ALA	GLU	ASP	ILE	ARG	ASP	ILE	TYR
5	ASP	PHE	ARG	ASP	VAL	LEU	GLY	THR	GLY	ALA
6	PHE	SER	GLU	VAL	ILE	LEU	ALA	GLU	ASP	LYS
7	ARG	THR	GLN	LYS	LEU	VAL	ALA	ILE	LYS	CYS
8	ILE	ALA	LYS	LYS	ALA	LEU	GLU	GLY	LYS	GLU
9	GLY	SER	MET	GLU	ASN	GLU	ILE	ALA	VAL	LEU
10	HIS	LYS	ILE	LYS	HIS	PRO	ASN	ILE	VAL	ALA
11	LEU	ASP	ASP	ILE	TYR	GLU	SER	GLY	GLY	HIS
12	LEU	TYR	LEU	ILE	MET	GLN	LEU	VAL	SER	GLY
13	GLY	GLU	LEU	PHE	ASP	ARG	ILE	VAL	GLU	LYS
14	GLY	PHE	TYR	THR	GLU	ARG	ASP	ALA	SER	ARG
15	LEU	ILE	PHE	GLN	VAL	LEU	ASP	ALA	VAL	LYS
16	TYR	LEU	HIS	ASP	LEU	GLY	ILE	VAL	HIS	ARG
17	ASP	LEU	LYS	PRO	GLU	ASN	LEU	LEU	TYR	TYR
18	SER	LEU	ASP	GLU	ASP	SER	LYS	ILE	MET	ILE
19	SER	ASP	PHE	GLY	LEU	SER	LYS	MET	GLU	ASP
20	PRO	GLY	SER	VAL	LEU	SER	THR	ALA	CYS	GLY
21	THR	PRO	GLY	TYR	VAL	ALA	PRO	GLU	VAL	LEU
22	ALA	GLN	LYS	PRO	TYR	SER	LYS	ALA	VAL	ASP
23	CYS	TRP	SER	ILE	GLY	VAL	ILE	ALA	TYR	ILE
24	LEU	LEU	CYS	GLY	TYR	PRO	PRO	PHE	TYR	ASP
25	GLU	ASN	ASP	ALA	LYS	LEU	PHE	GLU	GLN	ILE
26	LEU	LYS	ALA	GLU	TYR	GLU	PHE	ASP	SER	PRO
27	TYR	TRP	ASP	ASP	ILE	SER	ASP	SER	ALA	LYS
28	ASP	PHE	ILE	ARG	HIS	LEU	MET	GLU	LYS	ASP
29	PRO	GLU	LYS	ARG	PHE	THR	CYS	GLU	GLN	ALA
30	LEU	GLN	HIS	PRO	TRP	ILE	ALA	GLY	ASP	THR
31	ALA	LEU	ASP	LYS	ASN	ILE	HIS	GLN	SER	VAL
32	SER	GLU	GLN	ILE	LYS	LYS	ASN	PHE	ALA	LYS
33	SER	LYS	TRP	LYS	GLN	ALA	PHE	ASN	ALA	THR
34	ALA	VAL	VAL	ARG	HIS	MET	ARG	LYS	LEU	GLN