2PC5

native crystal structure analysis on arabidopsis dutpase

• Total interactions analyzed: 3
• Total true interactions: 3
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 126
  • Norm. En. per Res.: -4.282
• 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	-109.6867	5.406	-435.25	-539.5307	126	22	16	17571	1	41	31
A-C	-98.6958	10.0347	-455.24	-543.9011	130	23	18	17656	0	41	30
B-C	-81.3414	9.4765	-429.496	-501.3609	121	21	18	16206	0	37	29

Interface residues

• A-B: ALA101A, ALA106A, ALA106B, ALA38B, ALA49B, ALA63A, ALA67A, ALA76A, ALA76B, ALA83A, ALA86A, ALA86B, ALA92B, ARG109A, ARG109B, ARG43B, ARG64A, ARG64B, ARG84A, ARG84B, ARG88B, ASN118A, ASN118B, ASP105A, ASP107A, ASP107B, ASP121B, ASP144A, ASP149A, ASP150A, ASP152A, ASP98A, ASP98B, GLN134B, GLU138A, GLU138B, GLU147A, GLU36B, GLU79A, GLY100A, GLY102A, GLY110B, GLY113A, GLY44B, GLY50B, GLY65A, GLY80A, GLY80B, GLY90B, HIS119A, HIS119B, HIS95B, ILE104A, ILE115A, ILE136B, ILE137B, ILE140A, ILE140B, ILE40B, ILE69A, ILE75B, ILE85A, ILE85B, ILE97B, LEU116A, LEU135B, LEU151A, LEU34B, LEU47B, LEU53B, LEU68A, LEU73B, LEU91B, LYS139A, LYS139B, LYS30B, LYS32B, LYS33B, LYS66A, LYS94B, PHE117A, PHE117B, PHE28A, PHE28B, PHE29B, PRO111B, PRO143A, PRO27B, PRO41B, PRO46B, PRO62A, PRO78A, PRO78B, PRO87B, SER120A, SER120B, SER26B, SER35B, SER45B, SER48B, SER74B, SER89B, SER96B, THR142A, THR42B, THR81A, THR81B, TRP93B, TYR108A, TYR108B, TYR51B, TYR82A, TYR82B, VAL103A, VAL112B, VAL114A, VAL141A, VAL145A, VAL146A, VAL148A, VAL31B, VAL39B, VAL77A, VAL77B, VAL99A, VAL99B
• A-C: ALA101C, ALA106A, ALA106C, ALA38A, ALA49A, ALA63C, ALA67C, ALA76A, ALA76C, ALA83A, ALA83C, ALA86A, ALA86C, ALA92A, ARG109A, ARG109C, ARG43A, ARG64A, ARG64C, ARG84A, ARG84C, ARG88A, ASN118A, ASN118C, ASP105C, ASP107A, ASP107C, ASP121A, ASP121C, ASP144C, ASP149C, ASP150C, ASP152C, ASP98A, ASP98C, GLN134A, GLU138A, GLU138C, GLU147C, GLU36A, GLU79C, GLY100C, GLY102C, GLY110A, GLY113C, GLY44A, GLY50A, GLY65C, GLY80A, GLY80C, GLY90A, HIS119A, HIS119C, HIS95A, ILE104C, ILE115C, ILE136A, ILE137A, ILE140A, ILE140C, ILE40A, ILE69C, ILE75A, ILE85A, ILE85C, ILE97A, LEU116C, LEU135A, LEU151C, LEU34A, LEU47A, LEU68C, LEU73A, LEU91A, LYS139A, LYS139C, LYS30A, LYS32A, LYS33A, LYS60C, LYS66C, LYS94A, PHE117A, PHE117C, PHE28A, PHE28C, PHE29A, PRO111A, PRO143C, PRO27A, PRO41A, PRO46A, PRO62C, PRO78A, PRO78C, PRO87A, SER120A, SER120C, SER26A, SER45A, SER48A, SER59C, SER74A, SER89A, SER96A, THR142C, THR42A, THR81A, THR81C, TRP93A, TYR108A, TYR108C, TYR51A, TYR82A, TYR82C, VAL103C, VAL112A, VAL114C, VAL141A, VAL141C, VAL145C, VAL146C, VAL148C, VAL31A, VAL39A, VAL61C, VAL77A, VAL77C, VAL99A, VAL99C
• B-C: ALA101B, ALA106B, ALA38C, ALA49C, ALA63B, ALA67B, ALA76B, ALA76C, ALA83B, ALA86B, ALA86C, ALA92C, ARG109B, ARG109C, ARG43C, ARG64B, ARG64C, ARG84B, ARG84C, ARG88C, ASN118B, ASN118C, ASP105B, ASP107B, ASP121B, ASP121C, ASP144B, ASP149B, ASP150B, ASP52C, ASP98B, ASP98C, GLN134C, GLU138B, GLU138C, GLU147B, GLU79B, GLY100B, GLY102B, GLY113B, GLY44C, GLY50C, GLY65B, GLY80B, GLY80C, GLY90C, HIS119B, HIS119C, HIS95C, ILE104B, ILE115B, ILE136C, ILE137C, ILE140B, ILE140C, ILE40C, ILE69B, ILE75C, ILE85B, ILE85C, ILE97C, LEU116B, LEU135C, LEU34C, LEU47C, LEU68B, LEU73C, LEU91C, LYS139B, LYS139C, LYS30C, LYS32C, LYS33C, LYS66B, LYS94C, PHE117B, PHE117C, PHE28B, PHE28C, PHE29C, PRO143B, PRO27C, PRO41C, PRO46C, PRO62B, PRO78B, PRO78C, PRO87B, PRO87C, SER120B, SER120C, SER26C, SER45C, SER48C, SER59B, SER74C, SER89C, SER96C, THR142B, THR42C, THR81B, THR81C, TRP93C, TYR108B, TYR51C, TYR82B, TYR82C, VAL103B, VAL114B, VAL141B, VAL141C, VAL145B, VAL146B, VAL148B, VAL31C, VAL39C, VAL61B, VAL77B, VAL77C, VAL99B, VAL99C