2Y4O

crystal structure of paak2 in complex with phenylacetyl adenylate

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 192
  • Norm. En. per Res.: -4.1143
• Hub Node: A(1)

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-B	-87.5562	-151.5	-550.897	-789.9532	192	36	7	22742	10	52	61

Interface residues

• A-B: ALA111A, ALA111B, ALA155A, ALA155B, ALA299A, ALA299B, ALA96A, ALA96B, ARG131A, ARG131B, ARG157A, ARG157B, ARG178A, ARG178B, ARG403A, ARG403B, ARG88A, ARG88B, ARG93A, ARG93B, ASN138A, ASN138B, ASP134A, ASP134B, ASP179A, ASP179B, CYS160A, CYS160B, GLN169A, GLN169B, GLN173A, GLN173B, GLN175A, GLN175B, GLN202A, GLN202B, GLN346A, GLN346B, GLN90A, GLN90B, GLU156A, GLU156B, GLU171A, GLU171B, GLU181A, GLU181B, GLU198A, GLU198B, GLU349A, GLU349B, GLU399B, GLU89A, GLU89B, GLY102A, GLY102B, GLY108A, GLY108B, GLY133A, GLY133B, GLY141A, GLY141B, GLY143A, GLY143B, GLY148A, GLY148B, GLY159A, GLY159B, GLY167A, GLY167B, GLY168A, GLY168B, GLY409A, GLY409B, HIS137A, HIS137B, HIS152A, HIS152B, HIS402A, HIS402B, HIS6A, HIS6B, HIS95A, HIS95B, ILE114A, ILE114B, ILE350A, ILE350B, ILE404A, ILE404B, LEU136A, LEU136B, LEU144A, LEU144B, LEU149A, LEU149B, LEU158A, LEU158B, LEU176A, LEU176B, LYS103A, LYS103B, LYS172A, LYS172B, LYS183A, LYS183B, LYS405A, LYS405B, MET161A, MET161B, MET165A, MET165B, MET407A, MET407B, PHE140A, PHE140B, PHE145A, PHE145B, PHE180A, PHE180B, PHE81A, PHE81B, PHE84A, PHE84B, PRO104A, PRO104B, PRO132A, PRO132B, PRO164A, PRO164B, PRO182A, PRO182B, PRO80A, PRO80B, PRO87A, PRO87B, SER166A, SER166B, SER210A, SER210B, SER97A, SER97B, SER98A, SER98B, THR101A, THR101B, THR105A, THR105B, THR110A, THR110B, THR135A, THR135B, THR146A, THR146B, THR170A, THR170B, THR406A, THR406B, TRP117A, TRP117B, TYR109A, TYR109B, TYR142A, TYR142B, TYR153A, TYR153B, TYR191A, TYR191B, TYR79A, TYR79B, VAL106A, VAL106B, VAL107A, VAL107B, VAL162A, VAL162B, VAL163A, VAL163B, VAL174A, VAL174B, VAL340B, VAL408A, VAL408B, VAL410A, VAL410B, VAL86A, VAL86B, VAL91A, VAL91B, VAL92A, VAL92B, VAL94A, VAL94B