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replica 1 | MDBind 2a4w 1 | MDRepo
Records
MDBind 2a4w 1
Experiments
replica 1
Overview
MD-A007HZ
MDBind 2a4w 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
7.668 nm
Y
6.681 nm
Z
7.663 nm
Box volume
392.60 nm³
System Composition
Total system
4,150
atoms
260
residues
Protein
3,967
atoms
258
residues
Nucleic acids
0
atoms
0
residues
Lipids
0
atoms
0
residues
Carbohydrates
182
atoms
1
residues
Solvent
0
atoms
Counter-Ions
Cations (+)
0
Anions (-)
0
Total ions
0
0
residues