2J23

cross-reactivity and crystal structure of malassezia sympodialis thioredoxin (mala s 13), a member of a new pan- allergen family

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 90
  • Norm. En. per Res.: -2.4237
• 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	-42.4173	3.3805	-179.093	-218.1299	90	7	2	8216	3	30	24

Interface residues

• A-B: ALA27A, ALA27B, ARG-1A, ASP45A, ASP45B, ASP58A, ASP58B, ASP60A, ASP60B, ASP9A, ASP9B, CYS30A, CYS30B, CYS33A, CYS33B, GLN10A, GLN10B, GLN13A, GLN13B, GLN3A, GLN3B, GLN62A, GLN62B, GLN64A, GLU41A, GLU41B, GLU61A, GLU61B, GLY0A, GLY31A, GLY31B, GLY37A, GLY37B, HIS-5A, HIS-5B, HIS-6B, HIS-8B, ILE36A, ILE36B, ILE43A, ILE5A, ILE5B, LEU-4A, LEU-4B, LYS12A, LYS12B, LYS34A, LYS34B, LYS42A, LYS42B, LYS56A, LYS56B, MET35A, MET35B, PHE11A, PHE11B, PHE40A, PHE40B, PHE54A, PHE54B, PRO-2A, PRO-2B, PRO38A, PRO38B, SER1A, SER44A, SER44B, SER6A, SER6B, SER7A, SER7B, THR28A, THR28B, TRP26A, TRP26B, TRP29A, TRP29B, TYR55A, TYR55B, TYR8A, TYR8B, VAL-3A, VAL-3B, VAL14A, VAL14B, VAL2A, VAL2B, VAL4A, VAL4B, VAL59B