2OZ4

structural plasticity in igsf domain 4 of icam-1 mediates cell surface dimerization

• Total interactions analyzed: 3
• Total true interactions: 3
• Strongest Interaction:
  • Chains: A-H
  • Int. Res.: 78
  • Norm. En. per Res.: -3.2756
• Hub Node: A(2)

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
A-L	-4.7022	-22.4118	-95.5833	-122.6973	48	6	0	3442	2	7	8
A-H	-48.5753	-19.8865	-187.034	-255.4958	78	7	0	6912	2	14	13
L-H	-26.5288	-17.8449	-455.855	-500.2287	179	5	9	17633	0	17	14

Interface residues

• A-L: ARG340A, ARG370A, ARG374A, ARG441A, ASN379A, ASN92L, ASP337A, ASP372A, ASP375A, CYS376A, CYS392A, GLN27L, GLN393A, GLN89L, GLN90L, GLU336A, GLU373A, GLU49L, GLU53L, GLY30L, GLY378A, HIS34L, ILE29L, ILE2L, ILE33L, ILE48L, ILE55L, LEU371A, LEU46L, MET391A, PHE36L, PHE96L, PRO377A, PRO390A, PRO95L, SER32L, SER56L, SER91L, THR31L, THR334A, THR381A, THR389A, TRP380A, TRP382A, TRP395A, TRP94L, TYR50L, VAL93L
• A-H: ALA102H, ALA394A, ARG340A, ARG370A, ARG374A, ASN338A, ASN397A, ASN52H, ASN55H, ASP337A, ASP372A, ASP375A, CYS376A, CYS392A, GLN387A, GLN388A, GLN393A, GLN62H, GLU1H, GLU31H, GLU336A, GLU362A, GLU373A, GLU401A, GLU416A, GLY100H, GLY26H, GLY339A, GLY396A, GLY415A, GLY49H, GLY50H, GLY56H, GLY57H, HIS35H, ILE414A, ILE51H, ILE54H, LEU399A, LEU402A, LEU70H, LYS65H, LYS99H, MET34H, MET391A, PHE101H, PHE29H, PHE32H, PRO335A, PRO377A, PRO383A, PRO390A, PRO398A, PRO400A, PRO413A, SER30H, SER341A, SER343A, SER386A, SER417A, SER58H, SER59H, THR28H, THR334A, THR33H, THR381A, THR389A, THR53H, THR98H, TRP380A, TRP382A, TRP395A, TRP47H, TYR103H, TYR27H, TYR367A, TYR60H, VAL2H
• L-H: ALA102H, ALA126H, ALA130L, ALA169H, ALA84L, ALA97H, ARG211L, ARG214H, ARG39L, ARG45L, ASN137L, ASN138L, ASN157L, ASN161L, ASN210L, ASN212L, ASN41L, ASN52H, ASP165L, ASP167L, ASP170L, ASP1L, ASP85L, CYS134L, CYS141H, CYS214L, CYS88L, CYS96H, GLN106H, GLN124L, GLN172H, GLN37L, GLN38L, GLN39H, GLN62H, GLN6H, GLN6L, GLN89L, GLN90L, GLU123L, GLU187L, GLU213L, GLU46H, GLU49L, GLY100H, GLY101L, GLY105H, GLY107H, GLY128L, GLY129L, GLY140H, GLY158L, GLY163H, GLY42H, GLY42L, GLY49H, GLY50H, GLY57H, GLY99L, HIS165H, HIS34L, HIS35H, ILE117L, ILE211H, ILE40L, ILE48H, ILE51H, ILE55L, LEU125H, LEU125L, LEU136L, LEU139H, LEU142H, LEU160L, LEU171H, LEU175H, LEU178H, LEU179L, LEU181L, LEU45H, LEU46L, LEU47L, LEU70H, LYS103L, LYS144H, LYS169L, LYS209H, LYS210H, LYS38H, LYS43H, LYS61H, LYS99H, MET136H, MET175L, MET34H, PHE101H, PHE118L, PHE135L, PHE139L, PHE167H, PHE209L, PHE36L, PHE64H, PHE96L, PHE98L, PRO119L, PRO120L, PRO124H, PRO127H, PRO168H, PRO213H, PRO44L, PRO95L, SER100L, SER116L, SER121H, SER121L, SER122L, SER127L, SER131L, SER162H, SER162L, SER173H, SER174L, SER176L, SER177L, SER179H, SER180H, SER181H, SER43L, SER44H, SER58H, SER59H, SER63H, SER91L, THR114L, THR126L, THR138H, THR164L, THR166H, THR172L, THR177H, THR178L, THR180L, THR183H, THR33H, THR97L, THR98H, TRP104H, TRP155H, TRP163L, TRP189H, TRP36H, TRP47H, TRP94L, TYR103H, TYR123H, TYR173L, TYR176H, TYR186L, TYR50L, TYR60H, TYR86L, TYR87L, TYR95H, VAL115L, VAL122H, VAL132L, VAL133L, VAL137H, VAL143H, VAL159L, VAL164H, VAL170H, VAL182H, VAL207H, VAL212H, VAL37H, VAL93H