Membrane-embedded P-gp with ATP bound, inward-facing conformation, Run A Pre-Equilibrated System Information

Picture
Membrane-embedded P-gp with ATP bound, inward-facing conformation, Run A.<br>P-gp with Mg2+ and ATP in a POPC+cholesterol membrane, cluster analysis, solvent removed.<br><br>Click to toggle size.

Fig 1. Membrane-embedded P-gp with ATP bound, inward-facing conformation, Run A.
P-gp with Mg2+ and ATP in a POPC+cholesterol membrane, cluster analysis, solvent removed.

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NameMembrane-embedded P-gp with ATP bound, inward-facing conformation, Run A
DescriptionP-gp with Mg2+ and ATP in a POPC+cholesterol membrane, cluster analysis, solvent removed
Temperature (K)0.0
Pressure (Bar)0.0
Equilibration time (ns)0.0
Time Step (ps)0.0
ProgramGROMACS 3.3.3
AuthorsMegan L. O'Mara
Literature ReferencePLoS ONE 9(3): e91916. doi:10.1371/journal.pone.0091916
Molecule box ID92

Affiliated molecules (1-4 of 4)

Molid  Formula  Iupac  Atoms  Charge  Curation 
2671 None - 47 -3 Manual
1596 None - 3 0 Manual*
1731 None - 74 0 Manual*
1506 None - 134 0 Manual*
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Membrane-embedded P-gp with ATP bound, inward-facing conformation, Run A PDB