Brand  (β version)

PDB ID: 6F5M

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Ligands
Code Name Style Show Link
SO4 Sulfate ion PoSSuM
ACT Acetate ion PoSSuM
CQH 5-[[4-[[(2~{S})-4-methyl-1-oxidanylidene-1-[(2-propylphenyl)amino]pentan-2-yl]carbamoyl]phenyl]methyl]-2-oxidanylidene-1,3-thiazol-1-ium-4-olate PoSSuM
Non-standard Residues
Code Name Show
Glycosylation
Code Name Emphasize
NAG 2-acetamido-2-deoxy-beta-D-glucopyranose
BMA Beta-D-mannopyranose
MAN Alpha-D-mannopyranose
FUC Alpha-L-fucopyranose
Modification
Code Name Show

Structure summary

Code : 6F5M   PDBj   RCSB PDB   PDBe
Header : HYDROLASE
Title : Crystal structure of highly glycosylated human leukocyte elastase in complex with a thiazolidinedione inhibitor
Release Data : 2018-08-08
Compound :
mol_id molecule chains synonym
1 Neutrophil elastase A,B Bone marrow serine protease,Elastase-2,Human leukocyte elastase,HLE,Medullasin,PMN elastase
ec: 3.4.21.37
Source :
mol_id organism_scientific organism_common
1 Homo sapiens  (taxid:9606) Human
Authors : Hochscherf, J., Pietsch, M., Tieu, W., Kuan, K., Hautmann, S., Abell, A., Guetschow, M., Niefind, K.
Keywords : human leukocyte elastase, human neutrophil elastase, parabolic inhibition, glycosylation, HYDROLASE
Exp. method : X-RAY DIFFRACTION ( 2.700 Å )
Citation :

Crystal structure of highly glycosylated human leukocyte elastase in complex with an S2' site binding inhibitor.

Hochscherf, J.,Pietsch, M.,Tieu, W.  et al.
(2018)  Acta Crystallogr F Struct Biol Commun  74 : 480 - 489

PubMed: 30084397
DOI: 10.1107/S2053230X1800537X

Unexpected active-site flexibility in the structure of human neutrophil elastase in complex with a new dihydropyrimidone inhibitor.

Hansen, G.,Gielen-Haertwig, H.,Reinemer, P.  et al.
(2011)  J. Mol. Biol.  409 : 681 - 691

PubMed: 21549129
DOI: 10.1016/j.jmb.2011.04.047

5-benzylidenerhodanine and 5-benzylidene-2-4-thiazolidinedione based antibacterials.

Zvarec, O.,Polyak, S.W.,Tieu, W.  et al.
(2012)  Bioorg. Med. Chem. Lett.  22 : 2720 - 2722

PubMed: 22444680
DOI: 10.1016/j.bmcl.2012.02.100

Reaction

Chain : A, B
UniProt : P08246 (ELNE_HUMAN)
Reaction: EC: Evidence:
Physiological Direction:
Hydrolysis of proteins, including elastin. Preferential cleavage: Val-|-Xaa > Ala-|-Xaa. 3.4.21.37 PubMed:36899106
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