× Due to a recent server update, this page will be slow for the next 1-2 hours. We apologize for any inconvenience this may cause.

Simulation report

Technical information

General information

Name: Endothelin receptor type b (apoform) (apoform)

PDB id: 6IGL

Activation state: Inactive

Description: Classical unbiased (NVT ensemble) complex flexibility assay.

Submitted by: GPCRmd community

System setup

Solvent type: Implicit

Membrane type: Homogeneous

Membrane composition: POPC

Ionic composition: Sodium ion (157 mM), Chloride (201 mM)

Number of molecules:

Water: 20459

POPC: 228

Chloride: 74

Sodium ion: 58

Endothelin receptor type B: 1

Total number of atoms: 97352

Simulation details

Software and version: ACEMD3, GPUGRID

Forcefield and version: CHARMM, c36 Jul 2020

Time step : 4.0 fs

Delta : 0.2 ns

Replicates: 3

Accumulated simulation time: 1.5 µs

Additonal parameters: Available at "Simulation protocol & starting files"

Simulation components


Visualization and trajectory sharing powered by NGL viewer and MDSrv

Open with GPCRmd Workbench


No mutations found

Other molecules


Specific State ID: 5152

(228 molecules)

Sodium ion

Specific State ID: 5153

(58 molecules)



Specific State ID: 5154

(74 molecules)



Specific State ID: 5151

(20459 molecules)