2VRE

crystal structure of human peroxisomal delta3,5, delta2,4-dienoyl coa isomerase

• Total interactions analyzed: 3
• Total true interactions: 3
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 164
  • Norm. En. per Res.: -4.0318
• 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	-82.4677	-21.0527	-541.996	-645.5164	172	23	21	22396	2	33	24
A-C	-89.2166	-55.1558	-516.849	-661.2214	164	16	17	20999	6	30	24
B-C	-92.6758	-20.7673	-502.144	-615.5871	160	17	17	20785	2	31	23

Interface residues

• A-B: ALA110B, ALA139A, ALA155B, ALA177B, ALA178B, ALA200B, ALA203B, ALA211A, ALA233A, ALA235A, ALA236A, ALA245A, ALA262A, ALA269A, ALA287A, ALA78A, ALA98B, ARG111B, ARG117B, ARG122B, ARG132B, ARG159A, ARG185A, ARG185B, ARG204B, ARG219A, ARG257A, ARG257B, ARG77A, ASN128B, ASN192A, ASN192B, ASN197B, ASN252A, ASN266A, ASN272A, ASP100B, ASP108B, ASP118B, ASP151B, ASP157A, ASP173B, ASP179B, ASP258A, ASP258B, ASP280A, ASP93B, CYS156A, GLN124B, GLN168B, GLN184B, GLN193A, GLN193B, GLN247A, GLN277A, GLN279A, GLN286A, GLU125B, GLU131B, GLU171B, GLU198B, GLU210B, GLU237A, GLU263A, GLY175B, GLY181B, GLY191A, GLY191B, GLY213A, GLY213B, GLY215A, HIS259A, HIS259B, ILE101B, ILE112B, ILE119B, ILE120B, ILE138A, ILE158A, ILE190A, ILE190B, ILE238A, ILE92B, LEU102B, LEU116B, LEU176B, LEU183B, LEU186A, LEU186B, LEU195B, LEU199B, LEU212A, LEU216A, LEU234A, LEU253A, LEU254A, LEU254B, LEU265A, LEU276A, LEU281A, LEU94B, LYS135A, LYS170B, LYS188A, LYS188B, LYS241A, LYS250A, LYS283A, MET273A, MET275A, MET95B, MET97B, PHE127B, PHE201B, PHE221A, PRO104B, PRO134A, PRO136A, PRO187A, PRO187B, PRO243A, SER113B, SER194B, SER214A, SER214B, SER218A, SER239A, SER240A, SER242A, SER248A, SER256A, SER260A, SER264A, SER270A, SER274A, SER284A, SER99B, THR121B, THR154A, THR154B, THR182B, THR202B, THR249A, THR278A, THR288A, THR289A, TRP114B, TRP271A, TYR115B, TYR123B, TYR160A, TYR255A, TYR255B, TYR267A, VAL109B, VAL137A, VAL153A, VAL169B, VAL172B, VAL174B, VAL180B, VAL189A, VAL189B, VAL196B, VAL217A, VAL244A, VAL246A, VAL251A, VAL261A, VAL268A, VAL282A, VAL285A
• A-C: ALA110A, ALA139C, ALA155A, ALA155C, ALA177A, ALA178A, ALA200A, ALA203A, ALA211C, ALA233C, ALA235C, ALA236C, ALA245C, ALA262C, ALA269C, ALA78C, ALA98A, ARG111A, ARG117A, ARG122A, ARG132A, ARG159C, ARG185A, ARG185C, ARG204A, ARG219C, ARG257A, ARG257C, ARG77C, ASN128A, ASN192A, ASN192C, ASN197A, ASN252C, ASN266C, ASN272C, ASP100A, ASP108A, ASP118A, ASP151A, ASP157C, ASP173A, ASP179A, ASP258A, ASP258C, ASP280C, CYS156C, GLN124A, GLN168A, GLN184A, GLN193A, GLN193C, GLN247C, GLN277C, GLN279C, GLU125A, GLU131A, GLU171A, GLU198A, GLU210A, GLU237C, GLU263C, GLY175A, GLY181A, GLY191A, GLY191C, GLY213A, GLY213C, GLY215C, HIS259A, HIS259C, ILE101A, ILE112A, ILE119A, ILE120A, ILE138C, ILE158C, ILE190A, ILE190C, ILE238C, LEU102A, LEU116A, LEU176A, LEU183A, LEU186A, LEU186C, LEU195A, LEU199A, LEU212C, LEU216C, LEU234C, LEU253C, LEU254A, LEU254C, LEU265C, LEU276C, LEU281C, LEU94A, LYS135C, LYS170A, LYS188A, LYS188C, LYS205A, LYS241C, LYS250C, MET206A, MET273C, MET275C, MET97A, PHE127A, PHE201A, PHE221C, PRO104A, PRO134C, PRO136C, PRO187A, PRO187C, PRO243C, SER113A, SER194A, SER214A, SER214C, SER218C, SER239C, SER240C, SER242C, SER248C, SER256C, SER260C, SER264C, SER270C, SER274C, THR121A, THR154A, THR154C, THR182A, THR202A, THR249C, THR278C, TRP114A, TRP271C, TYR115A, TYR123A, TYR160C, TYR255A, TYR255C, TYR267C, VAL109A, VAL137C, VAL153C, VAL169A, VAL172A, VAL174A, VAL180A, VAL189A, VAL189C, VAL196A, VAL217C, VAL244C, VAL246C, VAL251C, VAL261C, VAL268C, VAL282C
• B-C: ALA110C, ALA139B, ALA155B, ALA155C, ALA177C, ALA178C, ALA200C, ALA203C, ALA211B, ALA233B, ALA235B, ALA236B, ALA245B, ALA262B, ALA269B, ALA78B, ALA98C, ARG111C, ARG117C, ARG122C, ARG132C, ARG159B, ARG185B, ARG185C, ARG204C, ARG219B, ARG257B, ARG257C, ASN128C, ASN192B, ASN192C, ASN197C, ASN252B, ASN266B, ASN272B, ASP100C, ASP108C, ASP118C, ASP151C, ASP157B, ASP173C, ASP179C, ASP258B, ASP258C, ASP280B, CYS156B, GLN124C, GLN168C, GLN184C, GLN193B, GLN193C, GLN247B, GLN277B, GLN279B, GLU125C, GLU131C, GLU171C, GLU198C, GLU210C, GLU237B, GLU263B, GLY175C, GLY181C, GLY191B, GLY191C, GLY213B, GLY213C, GLY215B, HIS259B, HIS259C, ILE101C, ILE112C, ILE119C, ILE120C, ILE138B, ILE158B, ILE190B, ILE190C, ILE238B, LEU102C, LEU116C, LEU176C, LEU183C, LEU186B, LEU186C, LEU195C, LEU199C, LEU212B, LEU216B, LEU234B, LEU253B, LEU254B, LEU254C, LEU265B, LEU276B, LEU281B, LYS135B, LYS170C, LYS188B, LYS188C, LYS241B, LYS250B, MET273B, MET275B, MET97C, PHE127C, PHE201C, PHE221B, PRO104C, PRO134B, PRO136B, PRO187B, PRO187C, PRO243B, SER113C, SER194C, SER214B, SER214C, SER218B, SER239B, SER240B, SER242B, SER248B, SER256B, SER260B, SER264B, SER270B, SER274B, THR121C, THR154B, THR154C, THR182C, THR202C, THR249B, THR278B, TRP114C, TRP271B, TYR115C, TYR123C, TYR160B, TYR255B, TYR255C, TYR267B, VAL109C, VAL137B, VAL153B, VAL169C, VAL172C, VAL174C, VAL180C, VAL189B, VAL189C, VAL196C, VAL217B, VAL244B, VAL246B, VAL251B, VAL261B, VAL268B, VAL282B