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Chlorine in PDB 5qqv: Pandda Analysis Group Deposition -- Crystal Structure of Human ALAS2A in Complex with Z1545312521

Enzymatic activity of Pandda Analysis Group Deposition -- Crystal Structure of Human ALAS2A in Complex with Z1545312521

All present enzymatic activity of Pandda Analysis Group Deposition -- Crystal Structure of Human ALAS2A in Complex with Z1545312521:
2.3.1.37;

Protein crystallography data

The structure of Pandda Analysis Group Deposition -- Crystal Structure of Human ALAS2A in Complex with Z1545312521, PDB code: 5qqv was solved by G.A.Bezerra, W.Foster, H.Bailey, L.Shrestha, T.Krojer, R.Talon, J.Brandao-Neto, A.Douangamath, B.B.Nicola, F.Von Delft, C.H.Arrowsmith, A.Edwards, C.Bountra, P.E.Brennan, W.W.Yue, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 60.60 / 1.52
Space group C 1 2 1
Cell size a, b, c (Å), α, β, γ (°) 126.166, 108.799, 75.809, 90.00, 109.16, 90.00
R / Rfree (%) 20.8 / 23.2

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Pandda Analysis Group Deposition -- Crystal Structure of Human ALAS2A in Complex with Z1545312521 (pdb code 5qqv). 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 Pandda Analysis Group Deposition -- Crystal Structure of Human ALAS2A in Complex with Z1545312521, PDB code: 5qqv:

Chlorine binding site 1 out of 1 in 5qqv

Go back to Chlorine Binding Sites List in 5qqv
Chlorine binding site 1 out of 1 in the Pandda Analysis Group Deposition -- Crystal Structure of Human ALAS2A in Complex with Z1545312521


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Pandda Analysis Group Deposition -- Crystal Structure of Human ALAS2A in Complex with Z1545312521 within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl602

b:94.8
occ:1.00
CL1 B:NTV602 0.0 94.8 1.0
C3 B:NTV602 1.7 75.0 1.0
O B:HOH821 2.7 17.9 1.0
C4 B:NTV602 2.7 74.5 1.0
C2 B:NTV602 2.7 70.7 1.0
C1 B:NTV602 3.1 72.7 1.0
O B:HOH716 3.7 33.6 1.0
C5 B:NTV602 4.0 72.7 1.0
C7 B:NTV602 4.0 64.2 1.0
C6 B:NTV602 4.5 69.6 1.0
CD1 B:LEU566 4.6 23.9 1.0
NE2 B:HIS309 4.7 17.2 1.0

Reference:

G.A.Bezerra, W.Foster, H.Bailey, L.Shrestha, T.Krojer, R.Talon, J.Brandao-Neto, A.Douangamath, B.B.Nicola, F.Von Delft, C.H.Arrowsmith, A.Edwards, C.Bountra, P.E.Brennan, W.W.Yue. Pandda Analysis Group Deposition To Be Published.
Page generated: Fri Jul 26 15:51:52 2024

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