BMRB Entry 18976

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PDB ID: 2m3s
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full, LACS, SPARTA
BMRB Entry DOI: doi:10.13018/BMR18976
MolProbity Validation Chart

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Title:
CALMODULIN, I85L, F92E, H107I, L107I, A128T, M144R MUTANT
Deposition date:
2013-01-25
Original release date:
2013-07-22
Authors:
Korendovych, Ivan; Moroz, Yurii; Wu, Yibing; Cheng, Hong; Roder, Heinrich
Citation:

Citation: Moroz, Olesia; Moroz, Yurii; Wu, Yibing; Olsen, Alissa; Cheng, Hong; Mack, Korrie; McLaughlin, Jaclyn; Raymond, Elisabeth; Zhezherya, Krystyna; Roder, Heinrich; Korendovych, Ivan. "A single mutation in a regulatory protein produces evolvable allosterically regulated catalyst of nonnatural reaction"  Angew. Chem. Int. Ed. Engl. 52, 6246-6249 (2013).
PubMed: 23630096

Assembly members:

Assembly members:
entity_1, polymer, 151 residues, 17109.910 Da.
CALCIUM ION, non-polymer, 40.078 Da.

Natural source:

Natural source:   Common Name: chicken   Taxonomy ID: 9031   Superkingdom: Eukaryota   Kingdom: Metazoa   Genus/species: not available not available

Experimental source:

Experimental source:   Production method: recombinant technology   Host organism: Escherichia coli   Vector: pEXP5-NT/TOPO

Entity Sequences (FASTA):

Entity Sequences (FASTA):
entity_1: SLMADQLTEEQIAEFKEAFS LFDKDGDGTITTKELGTVMR SLGQNPTEAELQDMINEVDA DGNGTIDFPEFLTMMARKMK DTDSEEELREAFRVEDKDGN GYISAAELRIVMTNRGEKLT DEEVDEMIRETDIDGDGQVN YEEFVQRMTAK

Data sets:
Data typeCount
13C chemical shifts663
15N chemical shifts159
1H chemical shifts1043

Time Domain Data

Additional metadata:

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Assembly:

Entity Assembly IDEntity NameEntity ID
1Ca-containing EF-hand protein1
2CALCIUM ION_12
3CALCIUM ION_22
4CALCIUM ION_32
5CALCIUM ION_42

Entities:

Entity 1, Ca-containing EF-hand protein 151 residues - 17109.910 Da.

1   SERLEUMETALAASPGLNLEUTHRGLUGLU
2   GLNILEALAGLUPHELYSGLUALAPHESER
3   LEUPHEASPLYSASPGLYASPGLYTHRILE
4   THRTHRLYSGLULEUGLYTHRVALMETARG
5   SERLEUGLYGLNASNPROTHRGLUALAGLU
6   LEUGLNASPMETILEASNGLUVALASPALA
7   ASPGLYASNGLYTHRILEASPPHEPROGLU
8   PHELEUTHRMETMETALAARGLYSMETLYS
9   ASPTHRASPSERGLUGLUGLULEUARGGLU
10   ALAPHEARGVALGLUASPLYSASPGLYASN
11   GLYTYRILESERALAALAGLULEUARGILE
12   VALMETTHRASNARGGLYGLULYSLEUTHR
13   ASPGLUGLUVALASPGLUMETILEARGGLU
14   THRASPILEASPGLYASPGLYGLNVALASN
15   TYRGLUGLUPHEVALGLNARGMETTHRALA
16   LYS

Entity 2, CALCIUM ION_1 - Ca - 40.078 Da.

1   CA

Related Database Links:

PDB 2M3S

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