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Iodine in PDB 7msl: Structure of Anti-Crispr ACRIIC4 From Haemophilus Parainfluenzae

Protein crystallography data

The structure of Structure of Anti-Crispr ACRIIC4 From Haemophilus Parainfluenzae, PDB code: 7msl was solved by C.Pan, K.L.Maxwell, T.F.Moraes, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 36.87 / 1.73
Space group P 4 21 2
Cell size a, b, c (Å), α, β, γ (°) 82.45, 82.45, 27.34, 90, 90, 90
R / Rfree (%) 23.9 / 27.4

Iodine Binding Sites:

The binding sites of Iodine atom in the Structure of Anti-Crispr ACRIIC4 From Haemophilus Parainfluenzae (pdb code 7msl). This binding sites where shown within 5.0 Angstroms radius around Iodine atom.
In total 3 binding sites of Iodine where determined in the Structure of Anti-Crispr ACRIIC4 From Haemophilus Parainfluenzae, PDB code: 7msl:
Jump to Iodine binding site number: 1; 2; 3;

Iodine binding site 1 out of 3 in 7msl

Go back to Iodine Binding Sites List in 7msl
Iodine binding site 1 out of 3 in the Structure of Anti-Crispr ACRIIC4 From Haemophilus Parainfluenzae


Mono view


Stereo pair view

A full contact list of Iodine with other atoms in the I binding site number 1 of Structure of Anti-Crispr ACRIIC4 From Haemophilus Parainfluenzae within 5.0Å range:
probe atom residue distance (Å) B Occ
A:I101

b:32.6
occ:0.40
O A:HOH203 3.6 43.3 1.0
CD1 A:LEU80 4.2 25.0 1.0
CD2 A:LEU80 4.3 30.0 1.0
CB A:LEU80 4.4 21.2 1.0
CG A:LEU80 4.6 27.3 1.0
NE2 A:GLN84 4.9 47.4 1.0

Iodine binding site 2 out of 3 in 7msl

Go back to Iodine Binding Sites List in 7msl
Iodine binding site 2 out of 3 in the Structure of Anti-Crispr ACRIIC4 From Haemophilus Parainfluenzae


Mono view


Stereo pair view

A full contact list of Iodine with other atoms in the I binding site number 2 of Structure of Anti-Crispr ACRIIC4 From Haemophilus Parainfluenzae within 5.0Å range:
probe atom residue distance (Å) B Occ
A:I102

b:31.0
occ:0.34
O A:LYS83 4.9 37.7 1.0

Iodine binding site 3 out of 3 in 7msl

Go back to Iodine Binding Sites List in 7msl
Iodine binding site 3 out of 3 in the Structure of Anti-Crispr ACRIIC4 From Haemophilus Parainfluenzae


Mono view


Stereo pair view

A full contact list of Iodine with other atoms in the I binding site number 3 of Structure of Anti-Crispr ACRIIC4 From Haemophilus Parainfluenzae within 5.0Å range:
probe atom residue distance (Å) B Occ
A:I103

b:19.3
occ:0.69
CD1 A:PHE49 3.9 44.3 1.0
CA A:PHE49 4.0 38.0 1.0
CB A:PHE49 4.2 39.9 1.0
CB A:GLU52 4.3 41.9 1.0
CG A:GLU52 4.3 45.9 1.0
CD1 A:PHE48 4.3 36.4 1.0
CE1 A:PHE48 4.5 40.0 1.0
CG A:PHE49 4.6 46.1 1.0
N A:PHE49 4.6 39.6 1.0
CE1 A:PHE49 4.9 49.8 1.0
O A:PHE48 5.0 36.0 1.0
O A:PHE49 5.0 38.4 1.0

Reference:

S.Hwang, C.Pan, B.Garcia, A.R.Davidson, T.F.Moraes, K.L.Maxwell. Structural and Mechanistic Insight Into Crispr-CAS9 Inhibition By Anti-Crispr Protein ACRIIC4 Hpa. J.Mol.Biol. V. 434 67420 2022.
ISSN: ESSN 1089-8638
PubMed: 34954237
DOI: 10.1016/J.JMB.2021.167420
Page generated: Mon Aug 12 01:45:59 2024

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