Bromine in PDB 1n0r: 4ANK: A Designed Ankyrin Repeat Protein with Four Identical Consensus Repeats

The structure of 4ANK: A Designed Ankyrin Repeat Protein with Four Identical Consensus Repeats, PDB code: 1n0r was solved by L.K.Mosavi, D.L.Minor Jr., Z.-Y.Peng, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	19.65 / 1.50
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	28.429, 46.115, 81.588, 90.00, 90.00, 90.00
R / Rfree (%)	21.6 / 24.9

The binding sites of Bromine atom in the 4ANK: A Designed Ankyrin Repeat Protein with Four Identical Consensus Repeats (pdb code 1n0r). This binding sites where shown within 5.0 Angstroms radius around Bromine atom.
In total 2 binding sites of Bromine where determined in the 4ANK: A Designed Ankyrin Repeat Protein with Four Identical Consensus Repeats, PDB code: 1n0r:
Jump to Bromine binding site number: 1; 2;

Bromine binding site 1 out of 2 in the 4ANK: A Designed Ankyrin Repeat Protein with Four Identical Consensus Repeats


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 1 of 4ANK: A Designed Ankyrin Repeat Protein with Four Identical Consensus Repeats within 5.0Å range: probe atom residue distance (Å) B Occ A:Br127 b:2.0 occ:1.00 NE A:ARG44 3.1 22.0 1.0 O A:HOH139 3.3 13.9 1.0 ND2 A:ASN78 3.3 4.0 1.0 NH1 A:ARG77 3.4 8.6 1.0 NH2 A:ARG44 3.5 18.3 1.0 CZ A:ARG44 3.8 20.2 1.0 CD A:ARG77 3.8 4.8 1.0 CD2 A:LEU74 3.8 3.7 1.0 CG A:ARG44 3.9 8.8 1.0 CD A:ARG44 4.1 17.3 1.0 CB A:LEU74 4.2 2.0 1.0 CG A:LEU74 4.3 2.0 1.0 CZ A:ARG77 4.4 9.1 1.0 CD1 A:LEU74 4.4 3.2 1.0 CG A:ASN78 4.5 5.1 1.0 CA A:LEU74 4.6 2.0 1.0 NE A:ARG77 4.6 9.9 1.0 O A:HOH196 4.6 29.1 1.0 CG A:ARG77 4.6 3.3 1.0 NH2 A:ARG36 4.7 17.5 1.0 CB A:ARG44 4.7 5.5 1.0 O A:HOH166 4.7 22.4 1.0 O A:LEU74 4.7 2.0 1.0 CB A:ARG77 4.8 2.0 1.0 OD1 A:ASN78 4.8 8.8 1.0

Bromine binding site 2 out of 2 in the 4ANK: A Designed Ankyrin Repeat Protein with Four Identical Consensus Repeats


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 2 of 4ANK: A Designed Ankyrin Repeat Protein with Four Identical Consensus Repeats within 5.0Å range: probe atom residue distance (Å) B Occ A:Br128 b:2.0 occ:1.00 NE A:ARG77 3.4 9.9 1.0 ND2 A:ASN111 3.4 5.1 1.0 CD2 A:LEU107 3.6 9.9 1.0 CD A:ARG110 3.9 21.3 1.0 CD A:ARG77 4.1 4.8 1.0 NH2 A:ARG69 4.2 8.2 1.0 CG A:ARG77 4.3 3.3 1.0 NH2 A:ARG77 4.3 11.7 1.0 CZ A:ARG77 4.3 9.1 1.0 CB A:LEU107 4.4 3.0 1.0 CG A:ARG110 4.4 12.9 1.0 CB A:ARG110 4.4 8.2 1.0 CG A:LEU107 4.4 5.2 1.0 CA A:LEU107 4.4 2.6 1.0 CG A:ASN111 4.6 6.6 1.0 NE A:ARG110 4.7 28.3 1.0 O A:LEU107 4.7 3.8 1.0 NH1 A:ARG69 4.8 9.5 1.0 CZ A:ARG69 4.8 6.7 1.0 OD1 A:ASN111 4.8 11.7 1.0 CD1 A:LEU107 4.9 5.2 1.0

L.K.Mosavi, D.L.Minor Jr., Z.-Y.Peng. Consensus-Derived Structural Determinants of the Ankyrin Repeat Motif. Proc.Natl.Acad.Sci.Usa V. 99 16029 2002.
ISSN: ISSN 0027-8424
PubMed: 12461176
DOI: 10.1073/PNAS.252537899