. 2022 Nov 23;134(4):114. doi: 10.1007/s12039-022-02110-9

Table 2.

Comparison of interface statistics of the initial NiV glycoprotein-EFNB2, HeV glycoprotein-EFNB2, NiV glycoprotein-EFNB3 and HeV glycoprotein-EFNB3 complexes (before MD) with the average complex structures extracted from last 50 ns of 250 ns Molecular dynamics trajectory.

Nipah and Hendra Virus	Time	PPI complexes	No. of interface residues	Interface area (Ã²)	No. of salt bridges	No. of H-bonds	No. of non-bonded contacts
NiV Glycoprotein and Human EFNB2	Initial structure	NiV Glycoprotein (A)	32	1373	3	21	218
	Initial structure	EFNB2 (B)	27	1473	3	21	218
	Average Str. from last 50 ns	NiV Glycoprotein (A)	24	1219	4	16	141
	Average Str. from last 50 ns	EFNB2 (B)	23	1257	4	16	141
HeV Glycoprotein and Human EFNB2	Initial structure	HeVGlycoprotein (A)	30	1300	4	12	160
	Initial structure	EFNB2 (B)	26	1389	4	12	160
	Average Str. From last 50 ns	HeV Glycoprotein (A)	20	1123	2	11	75
	Average Str. From last 50 ns	EFNB2 (B)	16	1210	2	11	75
NiV Glycoprotein and Human EFNB3	Initial structure	NiV Glycoprotein (A)	24	997	4	11	127
	Initial structure	EFNB3 (B)	19	1166	4	11	127
	Average Str. From last 50 ns	NiV Glycoprotein (A)	20	934	1	6	73
	Average Str. From last 50 ns	EFNB3 (B)	12	1089	1	6	73
HeV Glycoprotein and Human EFNB3	Initial structure	HeV Glycoprotein (A)	26	1184	5	12	137
	Initial structure	EFNB3 (B)	26	1272	5	12	137
	Average Str. From last 50 ns	HeV Glycoprotein (A)	17	820	1	8	61
	Average Str. From last 50 ns	EFNB3 (B)	13	886	1	8	61

For each complex, interface statistics obtained from PDBsum server.