BMRB Entry 50032

Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR50032

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Title:
CDC25B - R544A
Deposition date:
2019-10-04
Original release date:
2019-10-29
Authors:
Reis, Andre
Citation:

Citation: Reis, Andre; Sayegh, Raphael; Marana, Sandro; Arantes, Guilherme. "Combining free energy simulations and NMR chemical-shift perturbation to identify transient cation-pi contacts in proteins"  J. Chem. Inf. Model. 60, 890-897 (2020).
PubMed: 31738549

Assembly members:

Assembly members:
entity_1, polymer, 218 residues, Formula weight is not available

Natural source:

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

Experimental source:

Experimental source:   Production method: recombinant technology   Host organism: Escherichia coli   Vector: pET-28a

Entity Sequences (FASTA):

Entity Sequences (FASTA):
entity_1: MGSSHHHHHHSSGLVPRGSH MEFQSDHRELIGDYSKAFLL QTVDGKHQDLKYISPETMVA LLTGKFSNIVDKFVIVDCRY PYEYEGGHIKTAVNLPLERD AESFLLKSPIAPCSLDKRVI LIFHCEFSSERGPRMCRFIR ERDRAVNDYPSLYYPEMYIL KGGYKEFFPQHPNFCEPQDY RPMNHEAFKDELKTFALKTR SWAGERSRRELCSRLQDQ

Data sets:
Data typeCount
15N chemical shifts144
1H chemical shifts144

Additional metadata:

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Assembly:

Entity Assembly IDEntity NameEntity ID
1CDC25B - R544A1

Entities:

Entity 1, CDC25B - R544A 218 residues - Formula weight is not available

1   METGLYSERSERHISHISHISHISHISHIS
2   SERSERGLYLEUVALPROARGGLYSERHIS
3   METGLUPHEGLNSERASPHISARGGLULEU
4   ILEGLYASPTYRSERLYSALAPHELEULEU
5   GLNTHRVALASPGLYLYSHISGLNASPLEU
6   LYSTYRILESERPROGLUTHRMETVALALA
7   LEULEUTHRGLYLYSPHESERASNILEVAL
8   ASPLYSPHEVALILEVALASPCYSARGTYR
9   PROTYRGLUTYRGLUGLYGLYHISILELYS
10   THRALAVALASNLEUPROLEUGLUARGASP
11   ALAGLUSERPHELEULEULYSSERPROILE
12   ALAPROCYSSERLEUASPLYSARGVALILE
13   LEUILEPHEHISCYSGLUPHESERSERGLU
14   ARGGLYPROARGMETCYSARGPHEILEARG
15   GLUARGASPARGALAVALASNASPTYRPRO
16   SERLEUTYRTYRPROGLUMETTYRILELEU
17   LYSGLYGLYTYRLYSGLUPHEPHEPROGLN
18   HISPROASNPHECYSGLUPROGLNASPTYR
19   ARGPROMETASNHISGLUALAPHELYSASP
20   GLULEULYSTHRPHEALALEULYSTHRARG
21   SERTRPALAGLYGLUARGSERARGARGGLU
22   LEUCYSSERARGLEUGLNASPGLN

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