3V4E

crystal structure of the galactoside o-acetyltransferase in complex with coa

• Total interactions analyzed: 3
• Total true interactions: 3
• Strongest Interaction:
  • Chains: B-C
  • Int. Res.: 128
  • Norm. En. per Res.: -2.8541
• 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	-32.6503	-1.8016	-310.373	-344.8249	129	5	7	11695	0	20	15
A-C	-36.301	-1.423	-314.85	-352.574	128	8	7	11732	0	20	15
B-C	-50.7283	-1.6534	-312.94	-365.3217	128	7	7	11749	0	20	15

Interface residues

• A-B: ALA112B, ALA144B, ALA159A, ALA15B, ALA173A, ALA26B, ALA28B, ALA42A, ARG121B, ARG182A, ARG25B, ARG27B, ARG39A, ARG46A, ASN100A, ASN106A, ASN106B, ASN117B, ASN122B, ASN136A, ASN16B, ASN176A, ASN176B, ASN186A, ASN36A, ASN36B, ASN60A, ASN80A, ASN84A, ASN86A, ASN86B, ASP185A, ASP187A, ASP30B, ASP68B, ASP70B, ASP99A, CYS107A, CYS107B, CYS178A, CYS32B, CYS87B, GLU123B, GLU126B, GLU153A, GLU34A, GLU34B, GLY104A, GLY108B, GLY124B, GLY140A, GLY141A, GLY141B, GLY154A, GLY158A, GLY160A, GLY160B, GLY175A, HIS114B, HIS119B, HIS120B, HIS142A, HIS142B, HIS170A, HIS37A, HIS37B, ILE103A, ILE157A, ILE184A, ILE31B, ILE65A, LEU116B, LEU146B, LEU172A, LEU188A, LEU35A, LYS127B, LYS183A, LYS29B, MET90B, PHE102A, PHE109B, PHE118B, PHE125B, PHE139A, PHE17B, PHE33A, PHE33B, PHE67B, PHE89B, PRO105A, PRO105B, PRO115B, PRO147B, PRO177A, PRO177B, PRO40A, PRO66A, PRO66B, SER135A, SER155A, SER161A, SER161B, SER171A, SER41A, SER62A, SER64A, THR113B, THR137A, THR164B, THR38A, THR69B, THR85A, THR85B, TRP12B, TRP138A, TYR110A, TYR110B, TYR82A, TYR88B, VAL101A, VAL143A, VAL143B, VAL145B, VAL156A, VAL162A, VAL162B, VAL163B, VAL174A
• A-C: ALA112A, ALA144A, ALA159C, ALA15A, ALA173C, ALA26A, ALA28A, ALA42C, ARG121A, ARG182C, ARG25A, ARG27A, ARG39C, ARG46C, ASN100C, ASN106A, ASN106C, ASN117A, ASN122A, ASN136C, ASN16A, ASN176A, ASN176C, ASN186C, ASN36A, ASN36C, ASN60C, ASN80C, ASN84C, ASN86A, ASN86C, ASP185C, ASP187C, ASP30A, ASP68A, ASP70A, ASP99C, CYS107A, CYS107C, CYS178C, CYS32A, CYS87A, GLU123A, GLU126A, GLU153C, GLU34A, GLU34C, GLY104C, GLY108A, GLY124A, GLY140C, GLY141A, GLY141C, GLY154C, GLY158C, GLY160A, GLY160C, GLY175C, HIS114A, HIS119A, HIS120A, HIS142A, HIS142C, HIS170C, HIS37A, HIS37C, ILE157C, ILE184C, ILE31A, ILE65C, LEU116A, LEU146A, LEU172C, LEU188C, LEU35C, LYS127A, LYS183C, LYS29A, MET90A, PHE102C, PHE109A, PHE118A, PHE125A, PHE139C, PHE17A, PHE33A, PHE33C, PHE67A, PHE89A, PRO105A, PRO105C, PRO115A, PRO147A, PRO177A, PRO177C, PRO40C, PRO66A, PRO66C, SER135C, SER155C, SER161A, SER161C, SER171C, SER41C, SER62C, SER64C, THR113A, THR137C, THR164A, THR38C, THR69A, THR85A, THR85C, TRP12A, TRP138C, TYR110A, TYR110C, TYR82C, TYR88A, VAL101C, VAL143A, VAL143C, VAL145A, VAL156C, VAL162A, VAL162C, VAL163A, VAL174C
• B-C: ALA112C, ALA144C, ALA159B, ALA15C, ALA173B, ALA26C, ALA28C, ALA42B, ARG121C, ARG182B, ARG25C, ARG27C, ARG39B, ARG46B, ASN100B, ASN106B, ASN106C, ASN117C, ASN122C, ASN136B, ASN16C, ASN176B, ASN176C, ASN186B, ASN36B, ASN36C, ASN60B, ASN80B, ASN84B, ASN86B, ASN86C, ASP185B, ASP187B, ASP30C, ASP68C, ASP70C, ASP99B, CYS107B, CYS107C, CYS178B, CYS32C, CYS87C, GLU123C, GLU126C, GLU153B, GLU34B, GLU34C, GLY104B, GLY108C, GLY124C, GLY140B, GLY141B, GLY141C, GLY154B, GLY158B, GLY160B, GLY160C, GLY175B, HIS114C, HIS119C, HIS120C, HIS142B, HIS142C, HIS170B, HIS37B, HIS37C, ILE103B, ILE157B, ILE184B, ILE31C, ILE65B, LEU116C, LEU146C, LEU172B, LEU188B, LEU35B, LYS127C, LYS183B, LYS29C, MET90C, PHE102B, PHE109C, PHE118C, PHE125C, PHE139B, PHE17C, PHE33B, PHE33C, PHE67C, PHE89C, PRO105B, PRO105C, PRO115C, PRO147C, PRO177B, PRO177C, PRO40B, PRO66B, PRO66C, SER135B, SER155B, SER161B, SER161C, SER171B, SER41B, SER62B, SER64B, THR113C, THR137B, THR164C, THR38B, THR69C, THR85B, THR85C, TRP12C, TRP138B, TYR110C, TYR82B, TYR88C, VAL101B, VAL143B, VAL143C, VAL145C, VAL156B, VAL162B, VAL162C, VAL163C, VAL174B