Bromine in PDB 7wb6: Crystal Structure of Bovine Pancreatic Trypsin in Complex with 4- Bromobenzamidine at Room Temperature

Enzymatic activity of Crystal Structure of Bovine Pancreatic Trypsin in Complex with 4- Bromobenzamidine at Room Temperature

All present enzymatic activity of Crystal Structure of Bovine Pancreatic Trypsin in Complex with 4- Bromobenzamidine at Room Temperature:
3.4.21.4;

Protein crystallography data

The structure of Crystal Structure of Bovine Pancreatic Trypsin in Complex with 4- Bromobenzamidine at Room Temperature, PDB code: 7wb6 was solved by N.Sakai, H.Okumura, M.Yamamoto, T.Kumasaka, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 44.07 / 1.48
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 54.57, 58.28, 67.35, 90, 90, 90
R / Rfree (%) 13.8 / 18.1

Other elements in 7wb6:

The structure of Crystal Structure of Bovine Pancreatic Trypsin in Complex with 4- Bromobenzamidine at Room Temperature also contains other interesting chemical elements:

Calcium (Ca) 1 atom

Bromine Binding Sites:

The binding sites of Bromine atom in the Crystal Structure of Bovine Pancreatic Trypsin in Complex with 4- Bromobenzamidine at Room Temperature (pdb code 7wb6). This binding sites where shown within 5.0 Angstroms radius around Bromine atom.
In total only one binding site of Bromine was determined in the Crystal Structure of Bovine Pancreatic Trypsin in Complex with 4- Bromobenzamidine at Room Temperature, PDB code: 7wb6:

Bromine binding site 1 out of 1 in 7wb6

Go back to Bromine Binding Sites List in 7wb6
Bromine binding site 1 out of 1 in the Crystal Structure of Bovine Pancreatic Trypsin in Complex with 4- Bromobenzamidine at Room Temperature


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 1 of Crystal Structure of Bovine Pancreatic Trypsin in Complex with 4- Bromobenzamidine at Room Temperature within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Br301

b:17.3
occ:1.00
 BR1 A:F5R301 0.0 17.3 1.0
C3 A:F5R301 1.9 12.1 1.0
C4 A:F5R301 2.8 15.7 1.0
C2 A:F5R301 2.8 13.0 1.0
OG A:SER200 3.4 11.7 1.0
O A:HOH409 3.5 19.2 1.0
O A:HOH473 3.6 20.6 1.0
O A:HOH521 4.0 29.5 1.0
CA A:GLN197 4.1 11.2 1.0
C5 A:F5R301 4.1 13.9 1.0
C1 A:F5R301 4.1 13.4 1.0
O A:SER215 4.4 7.9 1.0
N A:GLN197 4.4 10.3 1.0
NE2 A:HIS63 4.5 8.5 1.0
C6 A:F5R301 4.6 11.1 1.0
CB A:SER200 4.7 8.1 1.0
CB A:GLN197 4.7 14.3 1.0
O A:CYS196 4.7 8.5 1.0
C A:CYS196 4.7 8.8 1.0
CG A:GLN197 4.8 28.8 1.0

Reference:

H.Okumura, N.Sakai, H.Murakami, N.Mizuno, Y.Nakamura, G.Ueno, T.Masunaga, T.Kawamura, S.Baba, K.Hasegawa, M.Yamamoto, T.Kumasaka. In Situ Crystal Data-Collection and Ligand-Screening System at Spring-8. Acta Crystallogr.,Sect.F V. 78 241 2022.
ISSN: ESSN 2053-230X
PubMed: 35647681
DOI: 10.1107/S2053230X22005283
Page generated: Thu Jul 11 04:40:54 2024

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