BMRB Entry 30943

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PDB ID: 7ry6
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR30943
MolProbity Validation Chart

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Title:
Solution structure of first cyclization domain (Cy1) from yersiniabactin synthetase
Deposition date:
2021-08-24
Original release date:
2022-07-08
Authors:
Mishra, Subrata; Frueh, Dominique
Citation:

Citation: Mishra, Subrata; Kancherla, Aswani; Marincin, Kenneth; Bouvignies, Guillaume; Nerli, Santrupti; Sgourakis, Nikolaos; Dowling, Daniel; Frueh, Dominique. "Global protein dynamics as communication sensors in peptide synthetase domains"  Sci. Adv. 8, eabn6549-eabn6549 (2022).
PubMed: 35857508

Assembly members:

Assembly members:
entity_1, polymer, 453 residues, 51914.559 Da.

Natural source:

Natural source:   Common Name: Yersinia pestis   Taxonomy ID: 632   Superkingdom: Bacteria   Kingdom: not available   Genus/species: Yersinia pestis

Experimental source:

Experimental source:   Production method: recombinant technology   Host organism: Escherichia coli   Vector: pET30a

Entity Sequences (FASTA):

Entity Sequences (FASTA):
entity_1: MPDESSWPNMTESTPFPLTP VQHAYLTGRMPGQTLGGVGC HLYQEFEGHCLTASQLEQAI TTLLQRHPMLHIAFRPDGQQ VWLPQPYWNGVTVHDLRHND AESRQAYLDALRQRLSHRLL RVEIGETFDFQLTLLPDNRH RLHVNIDLLIMDASSFTLFF DELNALLAGESLPAIDTRYD FRSYLLHQQKINQPLRDDAR AYWLAKASTLPPAPVLPLAC EPATLREVRNTRRRMIVPAT RWHAFSNRAGEYGVTPTMAL ATCFSAVLARWGGLTRLLLN ITLFDRQPLHPAVGAMLADF TNILLLDTACDGDTVSNLAR KNQLTFTEDWEHRHWSGVEL LRELKRQQRYPHGAPVVFTS NLGRSLYSSRAESPLGEPEW GISQTPQVWIDHLAFEHHGE VWLQWDSNDALFPPALVETL FDAYCQLINQLCDDESAWQK PFADMLEHHHHHH

Data sets:
Data typeCount
13C chemical shifts1421
15N chemical shifts393
1H chemical shifts1374

Additional metadata:

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Assembly:

Entity Assembly IDEntity NameEntity ID
1unit_11

Entities:

Entity 1, unit_1 453 residues - 51914.559 Da.

1   METPROASPGLUSERSERTRPPROASNMET
2   THRGLUSERTHRPROPHEPROLEUTHRPRO
3   VALGLNHISALATYRLEUTHRGLYARGMET
4   PROGLYGLNTHRLEUGLYGLYVALGLYCYS
5   HISLEUTYRGLNGLUPHEGLUGLYHISCYS
6   LEUTHRALASERGLNLEUGLUGLNALAILE
7   THRTHRLEULEUGLNARGHISPROMETLEU
8   HISILEALAPHEARGPROASPGLYGLNGLN
9   VALTRPLEUPROGLNPROTYRTRPASNGLY
10   VALTHRVALHISASPLEUARGHISASNASP
11   ALAGLUSERARGGLNALATYRLEUASPALA
12   LEUARGGLNARGLEUSERHISARGLEULEU
13   ARGVALGLUILEGLYGLUTHRPHEASPPHE
14   GLNLEUTHRLEULEUPROASPASNARGHIS
15   ARGLEUHISVALASNILEASPLEULEUILE
16   METASPALASERSERPHETHRLEUPHEPHE
17   ASPGLULEUASNALALEULEUALAGLYGLU
18   SERLEUPROALAILEASPTHRARGTYRASP
19   PHEARGSERTYRLEULEUHISGLNGLNLYS
20   ILEASNGLNPROLEUARGASPASPALAARG
21   ALATYRTRPLEUALALYSALASERTHRLEU
22   PROPROALAPROVALLEUPROLEUALACYS
23   GLUPROALATHRLEUARGGLUVALARGASN
24   THRARGARGARGMETILEVALPROALATHR
25   ARGTRPHISALAPHESERASNARGALAGLY
26   GLUTYRGLYVALTHRPROTHRMETALALEU
27   ALATHRCYSPHESERALAVALLEUALAARG
28   TRPGLYGLYLEUTHRARGLEULEULEUASN
29   ILETHRLEUPHEASPARGGLNPROLEUHIS
30   PROALAVALGLYALAMETLEUALAASPPHE
31   THRASNILELEULEULEUASPTHRALACYS
32   ASPGLYASPTHRVALSERASNLEUALAARG
33   LYSASNGLNLEUTHRPHETHRGLUASPTRP
34   GLUHISARGHISTRPSERGLYVALGLULEU
35   LEUARGGLULEULYSARGGLNGLNARGTYR
36   PROHISGLYALAPROVALVALPHETHRSER
37   ASNLEUGLYARGSERLEUTYRSERSERARG
38   ALAGLUSERPROLEUGLYGLUPROGLUTRP
39   GLYILESERGLNTHRPROGLNVALTRPILE
40   ASPHISLEUALAPHEGLUHISHISGLYGLU
41   VALTRPLEUGLNTRPASPSERASNASPALA
42   LEUPHEPROPROALALEUVALGLUTHRLEU
43   PHEASPALATYRCYSGLNLEUILEASNGLN
44   LEUCYSASPASPGLUSERALATRPGLNLYS
45   PROPHEALAASPMETLEUGLUHISHISHIS
46   HISHISHIS

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