1PN2

crystal structure analysis of the selenomethionine labelled 2-enoyl-coa hydratase 2 domain of candida tropicalis multifunctional enzyme type 2

• Total interactions analyzed: 6
• Total true interactions: 3
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 111
  • Norm. En. per Res.: -4.74
• 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	-66.1473	-194.1941	-269.882	-530.2235	112	8	12	12423	22	45	28
A-C	0.0	0.0	-0.0263	-0.0263	2	0	0	5	0	1	1
C-D	-56.9003	-206.4688	-262.775	-526.144	111	7	12	12217	23	45	28

Interface residues

• A-B: ALA174A, ALA174B, ALA175A, ALA175B, ALA193A, ALA20A, ALA20B, ALA23A, ALA23B, ARG12A, ARG12B, ARG178A, ARG178B, ARG183A, ARG183B, ARG8A, ARG8B, ASN184A, ASN184B, ASN18A, ASN18B, ASN191A, ASN191B, ASN34A, ASN34B, ASN51A, ASN51B, ASP10A, ASP10B, ASP11A, ASP11B, ASP13A, ASP13B, ASP172A, ASP172B, ASP189A, ASP189B, ASP35A, ASP35B, GLN27A, GLN27B, GLU171A, GLU171B, GLU33A, GLU33B, GLY181A, GLY181B, GLY22A, GLY22B, HIS187A, HIS187B, ILE15A, ILE15B, ILE188A, ILE188B, ILE19A, ILE19B, LEU16A, LEU16B, LEU173A, LEU173B, LEU176A, LEU176B, LEU179A, LEU179B, LEU186A, LEU186B, LEU28A, LEU28B, LEU47A, LEU47B, LYS26A, LYS26B, PHE192A, PHE192B, PHE38A, PHE38B, PHE44A, PHE44B, PHE9A, PHE9B, PRO185A, PRO185B, PRO190A, PRO190B, PRO201A, PRO201B, PRO236A, PRO236B, SER170A, SER170B, SER180A, SER180B, SER36A, THR24A, THR24B, THR25A, THR25B, TRP7A, TRP7B, TYR177A, TYR177B, TYR17A, TYR17B, TYR30A, TYR30B, TYR32A, TYR32B, VAL14A, VAL14B, VAL31A, VAL31B
• A-C: ASP249A, GLN137C
• C-D: ALA174C, ALA174D, ALA175C, ALA175D, ALA20C, ALA20D, ALA23C, ALA23D, ARG12C, ARG12D, ARG178C, ARG178D, ARG183C, ARG183D, ARG8C, ARG8D, ASN184C, ASN184D, ASN18C, ASN18D, ASN191C, ASN191D, ASN34C, ASN34D, ASN51C, ASN51D, ASP10C, ASP10D, ASP11C, ASP11D, ASP13C, ASP13D, ASP172C, ASP172D, ASP182C, ASP189C, ASP189D, ASP35C, ASP35D, GLN27C, GLN27D, GLU171C, GLU171D, GLU33C, GLU33D, GLY181C, GLY181D, GLY22C, GLY22D, HIS187C, HIS187D, ILE15C, ILE15D, ILE188C, ILE188D, ILE19C, ILE19D, LEU16C, LEU16D, LEU173C, LEU173D, LEU176C, LEU176D, LEU179C, LEU179D, LEU186C, LEU186D, LEU28C, LEU28D, LEU47C, LEU47D, LYS26C, LYS26D, PHE192C, PHE192D, PHE38C, PHE38D, PHE44C, PHE44D, PHE9C, PHE9D, PRO185C, PRO185D, PRO190C, PRO190D, PRO201C, PRO201D, PRO236C, PRO236D, SER170C, SER170D, SER180C, SER180D, THR24C, THR24D, THR25C, THR25D, TRP7C, TRP7D, TYR177C, TYR177D, TYR17C, TYR17D, TYR30C, TYR30D, TYR32C, TYR32D, VAL14C, VAL14D, VAL31C, VAL31D