Decoding the deactivation mechanism of R192W mutation of ZAP-70 using molecular dynamics simulations and binding free energy calculations.

Zhang, Xuehua; Liang, Wenqi; Zheng, Guodong; Li, Bei

Zhang, Xuehua; Liang, Wenqi; Zheng, Guodong; Li, Bei.

Afiliación

Zhang X; Suzhou Hospital, Affiliated Hospital of Medical School, Nanjing University, Suzhou, China.
Liang W; Department of Emergency, Changhai Hospital, The First Affiliated Hospital of Naval Medical University, Shanghai, 200433, China.
Zheng G; Department of VIP Clinic, Changhai Hospital, The First Affiliated Hospital to Naval Medical University, Shanghai, 200433, China. zhengguodong1984@163.com.
Li B; Department of VIP Clinic, Changhai Hospital, The First Affiliated Hospital to Naval Medical University, Shanghai, 200433, China. lichina99@126.com.

J Mol Model ; 29(12): 371, 2023 Nov 13.

Article en En | MEDLINE | ID: mdl-37953318

Asunto(s)

Proteína Tirosina Quinasa ZAP-70; Dominios Homologos src; Humanos; Secuencia de Aminoácidos; Simulación de Dinámica Molecular; Mutación; Unión Proteica; Receptores de Antígenos de Linfocitos T/química; Dominios Homologos src/genética; Proteína Tirosina Quinasa ZAP-70/genética

Palabras clave

Autoimmunity disease; MM-GBSA; Molecular dynamics simulations; ZAP-70

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Texto completo: 1 Base de datos: MEDLINE Asunto principal: Dominios Homologos src / Proteína Tirosina Quinasa ZAP-70 Idioma: En Revista: J Mol Model Asunto de la revista: BIOLOGIA MOLECULAR Año: 2023 Tipo del documento: Article

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