Challenging AQP4 druggability for NMO-IgG antibody binding using molecular dynamics and molecular interaction fields.

Mangiatordi, Giuseppe Felice

Challenging AQP4 druggability for NMO-IgG antibody binding using molecular dynamics and molecular interaction fields. [electronic resource] - Biochimica et biophysica acta Jul 2015 - 1462-71 p. digital

Publication Type: Journal Article; Research Support, Non-U.S. Gov't

0006-3002

10.1016/j.bbamem.2015.03.019 doi


Aquaporin 4--chemistry
Aspartic Acid--chemistry
Binding Sites--genetics
Crystallography, X-Ray
Epitopes--chemistry
Humans
Hydrogen Bonding
Immunoglobulin G--chemistry
Kinetics
Leucine--chemistry
Molecular Dynamics Simulation
Neuromyelitis Optica--immunology
Point Mutation
Protein Binding
Threonine--chemistry