2PQ5

crystal structure of dual specificity protein phosphatase 13 (dusp13)

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 10
  • Norm. En. per Res.: -3.0995
• Hub Node: A(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
A-B	0.0	0.0	-30.9953	-30.9953	10	1	0	871	0	5	7
A-C	-20.6229	-39.9622	-107.773	-168.3581	56	7	1	4278	2	10	7
A-D	-45.2933	12.3765	-214.945	-247.8618	104	11	1	8154	0	15	20
B-C	-43.4541	9.8806	-215.113	-248.6865	101	13	1	8208	0	16	19
B-D	0.0	0.0	-7.5561	-7.5561	19	0	0	461	1	4	2
C-D	0.0	8.2744	-60.9282	-52.6538	32	3	1	2435	0	5	7

Interface residues

• A-B: ASP86A, ASP86B, GLN84A, GLN84B, GLY81A, GLY81B, LYS82A, LYS82B, PHE83A, PHE83B
• A-C: ALA104A, ALA29C, ALA78A, ALA79A, ALA80A, ARG144A, ARG182C, ARG190C, ASN107A, ASN107C, ASN177C, ASN189C, ASP105A, ASP106A, ASP111A, ASP188C, GLN183A, GLN183C, GLN185C, GLN24C, GLN32C, GLN84A, GLU103A, GLY101A, GLY179C, GLY192C, GLY81A, ILE102A, LEU112A, LEU181C, LEU187C, LEU191C, LEU28C, LEU31C, LYS82A, PHE109A, PHE109C, PHE110A, PHE110C, PHE180A, PHE180C, PHE83A, PRO108A, PRO108C, PRO118A, PRO25C, PRO26C, SER113A, SER178C, SER30C, THR27C, TYR100A, TYR115A, TYR99A, VAL114A, VAL186C
• A-D: ALA104D, ALA139A, ALA139D, ALA40A, ALA40D, ALA41A, ALA41D, ALA58A, ALA58D, ALA60A, ALA60D, ALA61A, ALA61D, ARG144A, ARG144D, ARG172A, ARG172D, ARG182A, ARG182D, ARG33A, ARG33D, ARG38A, ARG38D, ARG62A, ARG62D, ASN107A, ASN107D, ASN173A, ASN173D, ASN177A, ASN177D, ASN44A, ASN44D, ASP105A, ASP105D, ASP106A, ASP106D, ASP47A, ASP57A, ASP57D, ASP63A, ASP63D, ASP86A, ASP86D, CYS175A, CYS175D, GLN32A, GLN32D, GLN39A, GLN39D, GLN84A, GLN84D, GLY141A, GLY141D, GLY179A, GLY179D, GLY81D, HIS45A, HIS45D, ILE174A, ILE174D, ILE46A, ILE46D, LEU28A, LEU34A, LEU35A, LEU35D, LEU43A, LEU43D, LYS64A, LYS64D, LYS66A, LYS66D, LYS82A, LYS82D, MET140A, MET140D, PHE109A, PHE109D, PHE180A, PHE83A, PHE83D, PHE91A, PHE91D, PRO108A, PRO108D, SER143A, SER143D, SER178A, SER178D, SER65A, SER65D, THR42A, THR42D, TRP36A, TRP36D, TYR59A, TYR59D, VAL142A, VAL142D, VAL37A, VAL37D, VAL85A, VAL85D
• B-C: ALA104B, ALA139B, ALA139C, ALA40B, ALA40C, ALA41B, ALA41C, ALA58B, ALA58C, ALA60B, ALA60C, ALA61C, ARG144B, ARG144C, ARG172B, ARG172C, ARG182B, ARG33B, ARG33C, ARG38B, ARG38C, ARG62B, ARG62C, ASN107B, ASN107C, ASN173B, ASN173C, ASN177B, ASN177C, ASN44B, ASN44C, ASP105B, ASP105C, ASP106B, ASP106C, ASP57B, ASP57C, ASP63C, ASP86B, ASP86C, CYS175B, CYS175C, GLN32B, GLN32C, GLN39B, GLN39C, GLN84B, GLN84C, GLY141B, GLY141C, GLY179B, GLY179C, GLY81B, GLY81C, HIS45B, HIS45C, ILE174B, ILE174C, ILE46B, ILE46C, LEU28B, LEU28C, LEU35B, LEU35C, LEU43B, LEU43C, LEU67C, LYS64C, LYS66B, LYS66C, LYS82B, LYS82C, MET140B, MET140C, PHE109B, PHE109C, PHE110B, PHE180B, PHE180C, PHE83B, PHE83C, PHE91C, PRO108B, PRO108C, SER143B, SER143C, SER178B, SER178C, SER65C, THR42B, THR42C, TRP36B, TRP36C, TYR59B, TYR59C, VAL142B, VAL142C, VAL37B, VAL37C, VAL85B, VAL85C
• B-D: ALA104B, ALA29D, ARG182D, ASN107B, ASN189D, ASP105B, GLN185D, GLN32D, GLN84B, GLU103B, GLY179D, LEU28D, LYS82B, PHE109D, PHE110B, PHE83B, PRO108D, SER178D, THR27D
• C-D: ARG182C, ARG182D, ASN107C, ASN107D, ASN177C, ASN177D, ASP105D, ASP111C, ASP111D, GLN183C, GLN183D, GLN185C, GLY179C, GLY179D, LEU112C, LEU181C, LEU181D, LEU184C, LEU28C, LEU28D, PHE109C, PHE109D, PHE110C, PHE110D, PHE180C, PHE180D, PRO108C, PRO108D, SER113C, SER178C, SER178D, VAL186C