Magnesium in PDB 6rai: Heterodimeric Abc Exporter Tmrab in Atp-Bound Outward-Facing Occluded Conformation

The binding sites of Magnesium atom in the Heterodimeric Abc Exporter Tmrab in Atp-Bound Outward-Facing Occluded Conformation (pdb code 6rai). This binding sites where shown within 5.0 Angstroms radius around Magnesium atom.
In total 2 binding sites of Magnesium where determined in the Heterodimeric Abc Exporter Tmrab in Atp-Bound Outward-Facing Occluded Conformation, PDB code: 6rai:
Jump to Magnesium binding site number: 1; 2;

Magnesium binding site 1 out of 2 in the Heterodimeric Abc Exporter Tmrab in Atp-Bound Outward-Facing Occluded Conformation


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 1 of Heterodimeric Abc Exporter Tmrab in Atp-Bound Outward-Facing Occluded Conformation within 5.0Å range: probe atom residue distance (Å) B Occ A:Mg702 b:41.9 occ:1.00 O A:HOH802 1.9 41.4 1.0 O A:HOH801 2.1 44.3 1.0 OG1 A:THR400 2.1 43.6 1.0 OE1 A:GLN441 2.4 47.3 1.0 O3B A:ATP701 2.4 40.0 1.0 O2G A:ATP701 2.7 40.0 1.0 PG A:ATP701 3.2 40.0 1.0 CB A:THR400 3.4 43.6 1.0 CD A:GLN441 3.5 47.3 1.0 PB A:ATP701 3.7 40.0 1.0 O3A A:ATP701 3.8 40.0 1.0 OD1 A:ASP522 3.9 50.2 1.0 OD2 A:ASP522 3.9 50.2 1.0 O2A A:ATP701 3.9 40.0 1.0 CG A:GLN441 4.1 47.3 1.0 O3G A:ATP701 4.1 40.0 1.0 CG2 A:THR400 4.2 43.6 1.0 O1G A:ATP701 4.2 40.0 1.0 N A:THR400 4.3 43.6 1.0 CG A:ASP522 4.4 50.2 1.0 CA A:THR400 4.4 43.6 1.0 N B:GLY477 4.5 38.2 1.0 O2B A:ATP701 4.5 40.0 1.0 CB A:GLN441 4.5 47.3 1.0 PA A:ATP701 4.6 40.0 1.0 O1B A:ATP701 4.6 40.0 1.0 NE2 A:GLN441 4.6 47.3 1.0

Magnesium binding site 2 out of 2 in the Heterodimeric Abc Exporter Tmrab in Atp-Bound Outward-Facing Occluded Conformation


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 2 of Heterodimeric Abc Exporter Tmrab in Atp-Bound Outward-Facing Occluded Conformation within 5.0Å range: probe atom residue distance (Å) B Occ B:Mg602 b:39.2 occ:1.00 OG B:SER378 2.1 40.9 1.0 O B:HOH701 2.1 41.8 1.0 O B:HOH702 2.1 41.6 1.0 O2B B:ATP601 2.2 48.1 1.0 O2G B:ATP601 2.3 48.1 1.0 OE1 B:GLN419 2.3 43.3 1.0 CB B:SER378 3.1 40.9 1.0 CD B:GLN419 3.5 43.3 1.0 PB B:ATP601 3.5 48.1 1.0 PG B:ATP601 3.6 48.1 1.0 OD1 B:ASP499 3.7 43.3 1.0 O3B B:ATP601 3.8 48.1 1.0 N B:SER378 4.0 40.9 1.0 NE2 B:GLN419 4.0 43.3 1.0 CA B:SER378 4.1 40.9 1.0 OD2 B:ASP499 4.2 43.3 1.0 O3G B:ATP601 4.2 48.1 1.0 O2A B:ATP601 4.3 48.1 1.0 CG B:ASP499 4.3 43.3 1.0 O1B B:ATP601 4.4 48.1 1.0 O1A B:ATP601 4.6 48.1 1.0 O3A B:ATP601 4.6 48.1 1.0 CG B:GLN419 4.7 43.3 1.0 PA B:ATP601 4.7 48.1 1.0 CB B:GLN419 4.7 43.3 1.0 O1G B:ATP601 4.8 48.1 1.0 OG1 A:THR499 5.0 42.8 1.0

S.Hofmann, D.Januliene, A.R.Mehdipour, C.Thomas, E.Stefan, S.Bruchert, B.T.Kuhn, E.R.Geertsma, G.Hummer, R.Tampe, A.Moeller. Conformation Space of A Heterodimeric Abc Exporter Under Turnover Conditions. Nature V. 571 580 2019.
ISSN: ESSN 1476-4687
PubMed: 31316210
DOI: 10.1038/S41586-019-1391-0