P-gp with NCP, ATP in a Cholesterol & POPC bilayer | PDB

P-gp with NCP, ATP in a Cholesterol & POPC bilayer Pre-Equilibrated System Information

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Name	P-gp with NCP, ATP in a Cholesterol & POPC bilayer
Description	P-gp with NCP, ATP in a Cholesterol & POPC bilayer
Temperature (K)	0.0
Pressure (Bar)	1.0
Equilibration time (ns)	5.0
Time Step (ps)	0.004
Program	gromacs 3.3.3 mdrun
Authors	Megan O'Mara
Literature Reference	unpublished work
Molecule box ID	88

Molid	Formula	Iupac	Common Name	Atoms	Charge	Date	Curation	Visibility
2009	C₂₆H₂₈N₃O₆	-	-	63	1	2010-12-15	ATB	Public
1731	None	-	-	74	0		Manual*	Public
2671	None	-	-	47	-3		Manual	Public
1646	None	-	-	3	0		Manual*	Public
1506	None	-	-	134	0		Manual*	Public

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Scientific Development:

Current Code Development:

Collaborators:

Biochemical and Biophysical Systems Group, Lawrence Livermore National Laboratory
Katarzyna Koziara
Gunnar Klau
Chris Oostenbrink
Daan Geerke
David Poger

Previous Contributors: