2C1J

molecular basis for the recognition of phosphorylated and phosphoacetylated histone h3 by 14-3-3

• Total interactions analyzed: 6
• Total true interactions: 3
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 107
  • Norm. En. per Res.: -2.9729
• 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-B	-38.16	-61.6601	-218.285	-318.105	107	10	11	10175	11	53	55
A-C	-7.3255	-36.5115	-42.3238	-86.1607	43	7	0	3024	2	7	10
B-D	-22.8751	-34.153	-59.676	-116.704	43	7	0	2981	2	6	9

Interface residues

• A-B: ALA10A, ALA10B, ALA13A, ALA13B, ALA16A, ALA16B, ALA23A, ALA23B, ALA24A, ALA24B, ALA54A, ALA54B, ALA79A, ALA79B, ARG18A, ARG18B, ARG55A, ARG55B, ARG56A, ARG60A, ARG60B, ARG80A, ARG80B, ARG83A, ARG83B, ASN4A, ASN4B, ASP20A, ASP20B, ASP21A, ASP21B, ASP2A, ASP2B, CYS25A, CYS25B, GLN15A, GLN15B, GLN76A, GLN76B, GLN77A, GLN77B, GLN8A, GLN8B, GLU14A, GLU14B, GLU17A, GLU17B, GLU5A, GLU5B, GLU66A, GLU66B, GLU81A, GLU81B, GLU87A, GLU87B, GLU89A, GLU89B, ILE65A, ILE65B, ILE86A, ILE86B, ILE93A, ILE93B, LEU12A, LEU12B, LEU6A, LEU6B, LEU90A, LEU90B, LYS11A, LYS11B, LYS74A, LYS74B, LYS75A, LYS75B, LYS85A, LYS85B, LYS9A, LYS9B, MET1A, MET1B, MET22A, MET22B, MET78A, MET78B, SER57A, SER57B, SER58A, SER58B, SER63A, SER63B, THR69A, THR69B, THR88A, THR88B, TRP59A, TRP59B, TYR19A, TYR19B, TYR82A, TYR82B, VAL61A, VAL61B, VAL62A, VAL62B, VAL7A, VAL7B
• A-C: ALA7C, ARG127A, ARG56A, ARG60A, ARG8C, ASN173A, ASN224A, ASN50A, ASP124A, ASP223A, GLU131A, GLU180A, GLY12C, GLY13C, GLY169A, GLY53A, ILE166A, ILE181A, ILE217A, LEU168A, LEU170A, LEU172A, LEU216A, LEU220A, LEU227A, LYS120A, LYS14C, LYS49A, MET121A, PHE117A, PHE174A, PHE177A, PRO165A, SER45A, THR11C, TRP228A, TYR125A, TYR128A, TYR149A, TYR179A, VAL176A, VAL46A, VAL52A
• B-D: ALA7D, ARG127B, ARG56B, ARG60B, ARG8D, ASN173B, ASN224B, ASN50B, ASP124B, ASP223B, GLU131B, GLU180B, GLY12D, GLY13D, GLY169B, GLY53B, ILE166B, ILE181B, ILE217B, LEU168B, LEU170B, LEU172B, LEU216B, LEU220B, LEU227B, LYS120B, LYS14D, LYS49B, MET121B, PHE117B, PHE174B, PHE177B, PRO165B, SER45B, THR11D, TRP228B, TYR125B, TYR128B, TYR149B, TYR179B, VAL176B, VAL46B, VAL52B