Magnesium in PDB 6o1v: Complex of Human Cystic Fibrosis Transmembrane Conductance Regulator (Cftr) and GLPG1837

All present enzymatic activity of Complex of Human Cystic Fibrosis Transmembrane Conductance Regulator (Cftr) and GLPG1837:
3.6.3.49;

The binding sites of Magnesium atom in the Complex of Human Cystic Fibrosis Transmembrane Conductance Regulator (Cftr) and GLPG1837 (pdb code 6o1v). This binding sites where shown within 5.0 Angstroms radius around Magnesium atom.
In total 2 binding sites of Magnesium where determined in the Complex of Human Cystic Fibrosis Transmembrane Conductance Regulator (Cftr) and GLPG1837, PDB code: 6o1v:
Jump to Magnesium binding site number: 1; 2;

Magnesium binding site 1 out of 2 in the Complex of Human Cystic Fibrosis Transmembrane Conductance Regulator (Cftr) and GLPG1837


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 1 of Complex of Human Cystic Fibrosis Transmembrane Conductance Regulator (Cftr) and GLPG1837 within 5.0Å range: probe atom residue distance (Å) B Occ A:Mg2002 b:1.0 occ:1.00 O2B A:ATP2004 2.0 0.8 1.0 O3G A:ATP2004 2.0 0.5 1.0 OG1 A:THR465 2.1 0.3 1.0 OE1 A:GLN493 2.5 0.4 1.0 PB A:ATP2004 3.1 0.2 1.0 PG A:ATP2004 3.2 0.7 1.0 O3B A:ATP2004 3.3 0.2 1.0 CB A:THR465 3.4 0.2 1.0 CD A:GLN493 3.5 0.8 1.0 OD1 A:ASP572 3.8 0.9 1.0 N A:THR465 3.8 0.3 1.0 NE2 A:GLN493 3.9 0.2 1.0 O1G A:ATP2004 4.0 0.1 1.0 O1B A:ATP2004 4.1 0.6 1.0 O2A A:ATP2004 4.1 0.4 1.0 CA A:THR465 4.1 0.6 1.0 O3A A:ATP2004 4.3 0.3 1.0 O2G A:ATP2004 4.3 0.8 1.0 NZ A:LYS464 4.4 0.1 1.0 OD2 A:ASP572 4.4 0.8 1.0 CG2 A:THR465 4.4 0.6 1.0 CG A:ASP572 4.5 0.3 1.0 PA A:ATP2004 4.6 0.8 1.0 CG A:GLN493 4.7 0.4 1.0 CB A:LYS464 4.8 0.3 1.0 O1A A:ATP2004 4.8 0.3 1.0 C A:LYS464 4.8 0.9 1.0 CB A:GLN493 4.9 0.7 1.0

Magnesium binding site 2 out of 2 in the Complex of Human Cystic Fibrosis Transmembrane Conductance Regulator (Cftr) and GLPG1837


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 2 of Complex of Human Cystic Fibrosis Transmembrane Conductance Regulator (Cftr) and GLPG1837 within 5.0Å range: probe atom residue distance (Å) B Occ A:Mg2003 b:0.2 occ:1.00 O2B A:ATP2005 1.9 0.7 1.0 O3G A:ATP2005 2.1 0.7 1.0 OG A:SER1251 2.2 0.2 1.0 OE1 A:GLN1291 2.5 0.1 1.0 PB A:ATP2005 3.1 0.8 1.0 CD A:GLN1291 3.2 0.1 1.0 PG A:ATP2005 3.4 0.1 1.0 CB A:SER1251 3.4 0.8 1.0 NE2 A:GLN1291 3.5 0.2 1.0 O3B A:ATP2005 3.5 0.8 1.0 OD1 A:ASP1370 3.5 0.4 1.0 O1B A:ATP2005 3.7 0.5 1.0 N A:SER1251 3.7 0.9 1.0 CA A:SER1251 4.0 0.1 1.0 OD2 A:ASP1370 4.1 0.6 1.0 O1G A:ATP2005 4.1 1.0 1.0 CG A:ASP1370 4.2 0.3 1.0 O3A A:ATP2005 4.4 0.1 1.0 O2G A:ATP2005 4.5 0.5 1.0 CB A:LYS1250 4.5 0.1 1.0 CG A:GLN1291 4.6 0.7 1.0 NZ A:LYS1250 4.6 0.1 1.0 O1A A:ATP2005 4.7 0.1 1.0 C A:LYS1250 4.7 0.7 1.0 O2A A:ATP2005 4.8 0.5 1.0 CE A:LYS1250 4.8 0.1 1.0 PA A:ATP2005 4.9 0.7 1.0 SG A:CYS1400 4.9 0.1 1.0

F.Liu, Z.Zhang, A.Levit, J.Levring, K.K.Touhara, B.K.Shoichet, J.Chen. Structural Identification of A Hotspot on Cftr For Potentiation. Science V. 364 1184 2019.
ISSN: ESSN 1095-9203
PubMed: 31221859
DOI: 10.1126/SCIENCE.AAW7611