2NW8

crystal structure of tryptophan 2,3-dioxygenase (tdo) from xanthomonas campestris in complex with ferrous heme and tryptophan. northeast structural genomics target xcr13.

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 209
  • Norm. En. per Res.: -5.7458
• 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	-165.5082	-111.5275	-923.837	-1200.8727	209	35	15	35866	15	75	58

Interface residues

• A-B: ALA36A, ALA36B, ALA44A, ALA44B, ALA66A, ALA66B, ALA71A, ALA71B, ALA72A, ALA72B, ALA89A, ALA89B, ARG117A, ARG117B, ARG158A, ARG158B, ARG21A, ARG21B, ARG239A, ARG239B, ARG246A, ARG246B, ARG29A, ARG29B, ARG70A, ARG70B, ARG90A, ARG90B, ARG96A, ARG96B, ASP118B, ASP152A, ASP152B, ASP31A, ASP31B, ASP47A, ASP47B, CB8.4740325.11478, GLN101A, GLN101B, GLN127A, GLN127B, GLN130A, GLN130B, GLN32A, GLN32B, GLN37A, GLN37B, GLN38A, GLN38B, GLN54A, GLN54B, GLN56A, GLN56B, GLN93A, GLN93B, GLN97A, GLN97B, GLU100A, GLU100B, GLU106A, GLU106B, GLU112A, GLU112B, GLU19A, GLU19A5, GLU48A, GLU48B, GLU59A, GLU59B, GLU68A, GLU68B, GLY121A, GLY121B, GLY125A, GLY125B, GLY20A, GLY25A, GLY25B, GLY26A, GLY26B, HIS45A, HIS45B, HIS46A, HIS46B, HIS55A, HIS55B, HIS67A, HIS67B, HIS75A, HIS75B, ILE52A, ILE52B, ILE53A, ILE53B, LEU105A, LEU105B, LEU108A, LEU108B, LEU120A, LEU120B, LEU129A, LEU129B, LEU22A, LEU22B, LEU28A, LEU28B, LEU30A, LEU30B, LEU33A, LEU33B, LEU34A, LEU34B, LEU40A, LEU40B, LEU50A, LEU50B, LEU60A, LEU60B, LEU62A, LEU62B, LEU64A, LEU64B, LEU65A, LEU65B, LEU69A, LEU69B, LEU88A, LEU88B, LEU95A, LEU95B, LEU98A, LEU98B, LYS63A, LYS63B, LYS86A, LYS86B, LYS92A, LYS92B, MET49A, MET49B, PHE116A, PHE116B, PHE126A, PHE126B, PHE149A, PHE149B, PHE51A, PHE51B, PRO110B, PRO122A, PRO122B, PRO39A, PRO39B, SER103A, SER103B, SER111A, SER111B, SER123A, SER123B, SER124A, SER124B, SER128A, SER128B, SER35A, SER35B, SER41A, SER41B, SER58A, SER58B, SER91A, SER91B, THR107A, THR107B, THR109A, THR109B, THR23A, THR23B, THR57A, THR57B, THR99A, THR99B, TRP102A, TRP102B, TRP236A, TRP61A, TRP61B, TRP82A, TRP82B, TYR113A, TYR113B, TYR131A, TYR131B, TYR151A, TYR151B, TYR24A, TYR24B, TYR27A, TYR27B, VAL104A, VAL104B, VAL119A, VAL119B, VAL148A, VAL148B, VAL87A, VAL87B, VAL94A, VAL94B