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replica 5 | MDBind 4mrd 1 | MDRepo
Records
MDBind 4mrd 1
Experiments
replica 5
Overview
MD-A007IR
MDBind 4mrd 1
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Overview
Trajectory viewer
Analyses
Force Field & Water Model
Force field
Amber ff14SB
GAFF
Water model
TIP3P
Simulation Parameters
Frames
50
Frequency
200 ps
Simulation length
10 ns
Timestep
2 fs
Temperature
N/A
Ensemble
N/A
Simulation Box
Box type
N/A
X
5.602 nm
Y
6.823 nm
Z
6.235 nm
Box volume
238.33 nm³
System Composition
Total system
2,366
atoms
150
residues
Protein
2,272
atoms
149
residues
Nucleic acids
0
atoms
0
residues
Lipids
0
atoms
0
residues
Carbohydrates
94
atoms
1
residues
Solvent
0
atoms
Counter-Ions
Cations (+)
0
Anions (-)
0
Total ions
0
0
residues