Author: Qiang Huang; Andreas Herrmann
Title: Fast assessment of human receptor-binding capability of 2019 novel coronavirus (2019-nCoV) Document date: 2020_2_3
ID: eecyduzq_12
Snippet: Significantly, the number of the native-like models among the top five scores (N5) is 5; also, their interface RMSDs are within 1.5 Ã…. Therefore, the lowest-energy conformations identified by the docking approach are almost identical to the experimental structure (PDB 2AJF). This provides a very solid basis for using this approach to investigate the S-RBD-ACE2 interactions of 2019-nCoV, in which no experimental complex structure is available bec.....
Document: Significantly, the number of the native-like models among the top five scores (N5) is 5; also, their interface RMSDs are within 1.5 Ã…. Therefore, the lowest-energy conformations identified by the docking approach are almost identical to the experimental structure (PDB 2AJF). This provides a very solid basis for using this approach to investigate the S-RBD-ACE2 interactions of 2019-nCoV, in which no experimental complex structure is available because of time limitation, but only the firstdetermined genome data that can be used to predict the 2019-nCoV S-RBD structure.
Search related documents:
Co phrase search for related documents- complex structure and experimental complex structure: 1, 2, 3, 4, 5, 6
- complex structure and experimental structure: 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11
- complex structure and interface rmsd: 1, 2
- complex structure and low energy: 1, 2, 3
- docking approach and experimental structure: 1
- docking approach and low energy: 1, 2
- experimental structure and low energy: 1, 2
- interface rmsd and low energy: 1, 2
Co phrase search for related documents, hyperlinks ordered by date