Chlorine in PDB 5mbw: Crystal Structure of Bace-1 in Complex with Pep#3

All present enzymatic activity of Crystal Structure of Bace-1 in Complex with Pep#3:
3.4.23.46;

The structure of Crystal Structure of Bace-1 in Complex with Pep#3, PDB code: 5mbw was solved by A.Kuglstatter, M.Stihle, J.Benz, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	47.45 / 2.95
Space group	F 2 3
Cell size a, b, c (Å), α, β, γ (°)	206.833, 206.833, 206.833, 90.00, 90.00, 90.00
R / Rfree (%)	16.3 / 21.6

The binding sites of Chlorine atom in the Crystal Structure of Bace-1 in Complex with Pep#3 (pdb code 5mbw). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total only one binding site of Chlorine was determined in the Crystal Structure of Bace-1 in Complex with Pep#3, PDB code: 5mbw:

Chlorine binding site 1 out of 1 in the Crystal Structure of Bace-1 in Complex with Pep#3


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Crystal Structure of Bace-1 in Complex with Pep#3 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl501 b:29.8 occ:0.33 NE A:ARG157 3.9 52.7 1.0 NH2 A:ARG157 4.2 55.2 1.0 CD2 A:LEU145 4.5 40.3 1.0 CZ A:ARG157 4.5 54.8 1.0 CD A:ARG157 4.9 47.1 1.0

N.Ruderisch, D.Schlatter, A.Kuglstatter, W.Guba, S.Huber, C.Cusulin, J.Benz, A.C.Rufer, J.Hoernschemeyer, C.Schweitzer, T.Bulau, A.Gartner, E.Hoffmann, J.Niewoehner, C.Patsch, K.Baumann, H.Loetscher, E.Kitas, P.O.Freskgard. Potent and Selective Bace-1 Peptide Inhibitors Lower Brain A Beta Levels Mediated By Brain Shuttle Transport. Ebiomedicine V. 24 76 2017.
ISSN: ESSN 2352-3964
PubMed: 28923680
DOI: 10.1016/J.EBIOM.2017.09.004