1Q4T

crystal structure of 4-hydroxybenzoyl coa thioesterase from arthrobacter sp. strain su complexed with 4-hydroxyphenyl coa

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 164
  • Norm. En. per Res.: -5.2641
• Hub Node: A(1)

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	-186.4938	-112.1545	-564.662	-863.3103	164	25	9	20598	8	33	18

Interface residues

• A-B: ALA10A, ALA138A, ALA138B, ALA145A, ALA145B, ALA19A, ALA19B, ALA25A, ALA25B, ALA67A, ALA67B, ALA70A, ALA70B, ALA72A, ALA72B, ALA79A, ALA79B, ALA82A, ALA82B, ALA91A, ALA91B, ARG102A, ARG102B, ARG149A, ARG149B, ARG150A, ARG150B, ARG57A, ARG57B, ARG59A, ARG59B, ASN14A, ASN14B, ASN96A, ASN96B, ASP17A, ASP17B, ASP31A, ASP31B, ASP54A, ASP54B, CYS69A, CYS69B, GLN28A, GLN28B, GLN58A, GLN58B, GLN94A, GLN94B, GLU27A, GLU27B, GLU73A, GLU73B, GLU78A, GLU78B, GLY12A, GLY12B, GLY13A, GLY13B, GLY32A, GLY32B, GLY61A, GLY61B, GLY65A, GLY65B, GLY66A, GLY66B, GLY93A, GLY93B, HIS21A, HIS21B, HIS64A, HIS64B, HIS85A, HIS85B, HIS97A, HIS97B, ILE144A, ILE144B, ILE38A, ILE38B, LEU15A, LEU15B, LEU30A, LEU30B, LEU56A, LEU56B, LEU62A, LEU62B, LEU71A, LEU71B, LEU75A, LEU75B, LYS105A, LYS105B, MET142A, MET142B, MET41A, MET41B, MET74A, MET74B, MET90A, MET90B, PHE100A, PHE100B, PHE101A, PHE101B, PHE124A, PHE124B, PHE36A, PHE36B, PRO103A, PRO103B, PRO16A, PRO16B, PRO23A, PRO23B, SER140A, SER140B, SER141A, SER141B, SER143A, SER143B, SER20A, SER20B, SER95A, SER95B, SER99A, SER99B, THR11A, THR29A, THR29B, THR33A, THR33B, THR53A, THR53B, THR55A, THR55B, THR77A, THR77B, THR98A, THR98B, TRP60A, TRP60B, TYR22A, TYR22B, TYR26A, TYR26B, TYR68A, TYR68B, VAL139A, VAL139B, VAL18A, VAL18B, VAL24A, VAL24B, VAL34A, VAL34B, VAL63A, VAL63B, VAL81A, VAL81B, VAL92A, VAL92B