Chlorine in PDB 7l1g: PRMT5-MEP50 Complexed with Sam

All present enzymatic activity of PRMT5-MEP50 Complexed with Sam:
2.1.1.320;

The structure of PRMT5-MEP50 Complexed with Sam, PDB code: 7l1g was solved by R.L.Palte, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	46.07 / 2.47
Space group	I 2 2 2
Cell size a, b, c (Å), α, β, γ (°)	101.548, 138.78, 178.156, 90, 90, 90
R / Rfree (%)	21.4 / 25.5

The binding sites of Chlorine atom in the PRMT5-MEP50 Complexed with Sam (pdb code 7l1g). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the PRMT5-MEP50 Complexed with Sam, PDB code: 7l1g:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the PRMT5-MEP50 Complexed with Sam


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of PRMT5-MEP50 Complexed with Sam within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl712 b:80.7 occ:1.00 O A:HOH801 2.9 63.1 1.0 O B:HOH526 2.9 63.8 1.0 O A:HOH905 3.0 58.3 1.0 O A:ARG154 3.0 54.8 1.0 O A:LEU126 3.2 56.4 1.0 CB A:ASN127 3.9 50.3 1.0 O A:HOH907 3.9 53.5 1.0 C A:LEU126 3.9 56.6 1.0 CD A:PRO156 3.9 54.7 1.0 C A:ARG154 3.9 55.8 1.0 O A:HOH811 4.0 61.0 1.0 CA A:ASN127 4.1 55.2 1.0 N A:LEU126 4.2 52.3 1.0 CB A:PRO125 4.2 55.3 1.0 N A:ASN127 4.2 54.9 1.0 CG A:PRO156 4.4 58.4 1.0 CA A:VAL155 4.5 51.0 1.0 CG A:ARG154 4.5 59.7 1.0 CB A:ARG154 4.5 57.2 1.0 CA A:PRO125 4.5 54.1 1.0 N A:VAL155 4.6 50.4 1.0 N A:PRO156 4.6 54.4 1.0 OE1 A:GLU207 4.6 81.7 1.0 CA A:LEU126 4.8 52.8 1.0 C A:VAL155 4.8 57.2 1.0 C A:PRO125 4.8 55.5 1.0 CG A:ASN127 4.9 63.1 1.0 CA A:ARG154 4.9 55.6 1.0 ND2 A:ASN127 4.9 54.7 1.0

Chlorine binding site 2 out of 2 in the PRMT5-MEP50 Complexed with Sam


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of PRMT5-MEP50 Complexed with Sam within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl713 b:90.3 occ:1.00 O A:ILE218 3.1 72.7 1.0 NH2 A:ARG256 3.2 90.7 1.0 CB A:TRP221 3.8 56.8 1.0 N A:LEU222 3.8 58.8 1.0 C A:TRP221 3.9 61.7 1.0 CG2 A:ILE218 4.0 69.2 1.0 C A:ILE218 4.0 70.1 1.0 CG A:LEU222 4.2 63.8 1.0 CZ A:ARG256 4.2 108.7 1.0 CA A:TRP221 4.2 59.1 1.0 NE A:ARG256 4.2 104.5 1.0 O A:TRP221 4.2 59.7 1.0 CD2 A:LEU222 4.3 65.4 1.0 CA A:LEU222 4.4 58.5 1.0 N A:TRP221 4.5 61.5 1.0 N A:ASP219 4.7 64.4 1.0 CA A:ASP219 4.7 63.4 1.0 CD1 A:ILE226 4.8 58.9 1.0 CB A:LEU222 4.8 58.6 1.0 CA A:ILE218 4.9 66.3 1.0 CG A:TRP221 4.9 57.0 1.0 CD1 A:LEU253 4.9 76.7 1.0

D.A.Candito, Y.Ye, R.V.Quiroz, M.H.Reutershan, D.Witter, S.B.Gadamsetty, H.Li, J.Sauri, S.E.Schneider, Y.H.Lam, R.L.Palte. Development of A Flexible and Robust Synthesis of Tetrahydrofuro[3,4- B ]Furan Nucleoside Analogues. J.Org.Chem. V. 86 5142 2021.
ISSN: ISSN 0022-3263
PubMed: 33755465
DOI: 10.1021/ACS.JOC.0C02969