Structural insight into G2019S mutated LRRK2 kinase and brain-penetrant type I inhibitor complex: a molecular dynamics approach.

Naskar, Avigyan; Bhanja, Kousik K; Roy, Rakesh K; Patra, Niladri

Naskar, Avigyan; Bhanja, Kousik K; Roy, Rakesh K; Patra, Niladri.

Afiliação

Naskar A; Department of Chemistry and Chemical Biology, Indian Institute of Technology (ISM) Dhanbad, Dhanbad, India.
Bhanja KK; Department of Chemistry and Chemical Biology, Indian Institute of Technology (ISM) Dhanbad, Dhanbad, India.
Roy RK; Department of Chemistry and Chemical Biology, Indian Institute of Technology (ISM) Dhanbad, Dhanbad, India.
Patra N; Department of Chemistry and Chemical Biology, Indian Institute of Technology (ISM) Dhanbad, Dhanbad, India.

J Biomol Struct Dyn ; : 1-21, 2023 Sep 13.

Article em En | MEDLINE | ID: mdl-37702159

Palavras-chave

CHK1 kinase; LRRK2 kinase domain; Molecular dynamics; dynamic cross-correlation; inhibitor

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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Idioma: En Revista: J Biomol Struct Dyn Ano de publicação: 2023 Tipo de documento: Article País de afiliação: Índia

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