3S88

crystal structure of sudan ebolavirus glycoprotein (strain gulu) bound to 16f6

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: H-L
  • Int. Res.: 194
  • Norm. En. per Res.: -2.5469
• Hub Node: H(3)

All Interactions

Chains	Hydro. Bond Ener. (kJ/mol)	Elec. Ener. (kJ/mol)	VDW. Ener. (kJ/mol)	Tot. Stab. Ener. (kJ/mol)	#int. res.	# Short cont.	#Hydr. int.	#VDW pairs	#salt bridges	#Pot. fav. elec. int	#Pot. unfav. elec. int
H-I	-6.9514	9.2038	-80.8521	-78.5996	38	0	4	3196	3	4	4
H-J	0.0	0.0	-61.393	-61.393	33	2	1	2178	0	1	2
H-L	-28.7616	-17.605	-447.726	-494.0926	194	22	10	18637	1	22	18
I-J	-82.9303	-61.1891	115.312	-28.8074	186	48	18	25187	5	46	35
I-L	0.0	0.0	-11.5229	-11.5229	13	0	0	562	0	1	1
J-L	0.0	0.0	-32.2654	-32.2654	20	1	1	1399	0	0	1

Interface residues

• H-I: ALA28H, ALA75H, ARG98H, ASN103H, ASN30H, ASP107H, ASP49I, GLN50I, GLU1H, GLU44I, GLU47I, GLY102H, GLY26H, GLY36I, ILE48I, LEU100H, LEU35I, LEU43I, LEU51I, LYS54I, LYS77H, MET33I, PHE105H, PHE27H, PHE29H, PRO34I, SER32I, SER41I, THR42I, THR46I, TYR101H, TYR108H, TYR31H, TYR32H, VAL2H, VAL37I, VAL45I, VAL52I
• H-J: ALA553J, ALA562J, ALA568J, ARG559J, ASN103H, ASN30H, ASN52H, ASN552J, ASN563J, ASP33H, CYS511J, CYS556J, GLN560J, GLN567J, GLN99H, GLU564J, GLY102H, GLY54H, GLY557J, LEU100H, LEU554J, LEU558J, LEU561J, PHE105H, PRO513J, SER104H, SER53H, THR565J, TYR101H, TYR31H, TYR32H, TYR50H, VAL555J
• H-L: ALA100L, ALA130L, ALA131H, ALA135H, ALA136H, ALA137H, ALA138H, ALA139H, ALA174H, ALA219H, ALA32L, ALA34L, ALA49H, ALA51L, ALA97H, ARG194H, ARG211L, ARG38H, ARG44H, ARG98H, ASN103H, ASN137L, ASN138L, ASN157L, ASN161L, ASN210L, ASN212L, ASN40H, ASP107H, ASP165L, ASP167L, ASP170L, ASP1L, ASP220H, ASP62H, CYS134L, CYS146H, CYS88L, CYS96H, GLN111H, GLN124L, GLN177H, GLN37L, GLN38L, GLN39H, GLN6L, GLN89L, GLN90L, GLN99H, GLU123L, GLU42H, GLU46H, GLU6H, GLY101L, GLY102H, GLY110H, GLY112H, GLY128L, GLY129L, GLY133H, GLY145H, GLY158L, GLY168H, GLY41L, GLY99L, HIS170H, HIS42L, HIS55L, HIS91L, ILE117L, ILE216H, ILE48L, LEU100H, LEU125L, LEU130H, LEU136L, LEU144H, LEU147H, LEU160L, LEU176H, LEU179L, LEU180H, LEU181L, LEU183H, LEU45H, LEU46L, LEU47L, LEU85L, LEU96L, LYS103L, LYS149H, LYS169L, LYS207L, LYS214H, LYS215H, LYS39L, LYS43H, LYS45L, LYS9L, MET141H, MET175L, MET93H, PHE105H, PHE106H, PHE10L, PHE118L, PHE135L, PHE139L, PHE172H, PHE209L, PHE35H, PHE98L, PRO119L, PRO120L, PRO129H, PRO132H, PRO173H, PRO40L, PRO44L, PRO61H, PRO95L, SER104H, SER116L, SER121L, SER122L, SER126H, SER127L, SER131L, SER134H, SER162L, SER167H, SER174L, SER176L, SER177L, SER178H, SER184H, SER185H, SER186H, SER208L, SER43L, SER93L, THR102L, THR114L, THR126L, THR143H, THR164L, THR171H, THR172L, THR178L, THR180L, THR182H, THR188H, THR41H, THR53L, THR56L, THR63H, THR94L, THR97L, TRP109H, TRP160H, TRP163L, TRP35L, TRP36H, TRP47H, TRP50L, TYR108H, TYR128H, TYR173L, TYR181H, TYR186L, TYR36L, TYR49L, TYR50H, TYR59H, TYR60H, TYR86L, TYR87L, TYR92L, TYR95H, VAL115L, VAL127H, VAL132L, VAL133L, VAL142H, VAL148H, VAL159L, VAL169H, VAL175H, VAL187H, VAL217H, VAL33L, VAL37H, VAL3L, VAL48H
• I-J: ALA101I, ALA105I, ALA158I, ALA166I, ALA177I, ALA182I, ALA520J, ALA539J, ALA553J, ALA562J, ALA568J, ALA575J, ALA589J, ALA58I, ARG130I, ARG134I, ARG136I, ARG164I, ARG559J, ARG574J, ARG580J, ARG587J, ARG595J, ARG596J, ARG89I, ASN40I, ASN512J, ASN514J, ASN550J, ASN563J, ASN586J, ASN69I, ASP127I, ASP156I, ASP163I, ASP49I, ASP55I, ASP591J, ASP607J, ASP61I, CYS135I, CYS511J, CYS53I, CYS556J, CYS601J, CYS608J, CYS609J, GLN50I, GLN521J, GLN551J, GLN560J, GLN567J, GLN570J, GLN62I, GLU100I, GLU103I, GLU106I, GLU191I, GLU287I, GLU44I, GLU47I, GLU540J, GLU545J, GLU564J, GLU578J, GLU611J, GLU71I, GLY102I, GLY128I, GLY131I, GLY157I, GLY179I, GLY286I, GLY36I, GLY538J, GLY541J, GLY546J, GLY557J, GLY605J, GLY67I, GLY72I, GLY74I, HIS154I, HIS516J, HIS524J, HIS56I, ILE181I, ILE185I, ILE285I, ILE48I, ILE542J, ILE584J, ILE590J, ILE610J, LEU161I, LEU165I, LEU184I, LEU186I, LEU35I, LEU43I, LEU515J, LEU51I, LEU547J, LEU554J, LEU558J, LEU561J, LEU569J, LEU571J, LEU573J, LEU579J, LEU57I, LEU585J, LEU593J, LEU594J, LEU63I, LEU68I, LEU70I, LYS188I, LYS510J, LYS54I, LYS588J, LYS64I, LYS95I, MET33I, MET548J, PHE132I, PHE153I, PHE159I, PHE160I, PHE183I, PHE572J, PHE592J, PRO125I, PRO126I, PRO133I, PRO34I, PRO513J, PRO606J, PRO93I, PRO94I, SER167I, SER32I, SER41I, SER59I, SER65I, SER73I, SER98I, THR168I, THR192I, THR39I, THR42I, THR46I, THR519J, THR544J, THR565J, THR566J, THR576J, THR577J, THR581J, THR583J, THR60I, TRP104I, TRP518J, TRP597J, TYR151I, TYR162I, TYR171I, TYR212I, TYR213I, TYR517J, TYR543J, TYR582J, TYR99I, VAL129I, VAL169I, VAL180I, VAL37I, VAL38I, VAL45I, VAL52I, VAL555J, VAL66I, VAL75I, VAL92I, VAL96I, VAL97I
• I-L: ARG54L, ASN40I, GLU44I, GLY57L, HIS55L, LEU43I, LEU46L, SER41I, THR39I, THR42I, THR53L, THR56L, TYR49L
• J-L: ALA32L, ALA51L, ALA553J, ASN512J, ASN550J, ASN552J, CYS511J, CYS556J, GLN551J, GLY557J, HIS91L, LEU554J, PRO513J, SER52L, THR30L, THR31L, THR53L, TRP50L, TYR49L, VAL555J