3MMH

x-ray structure of free methionine-r-sulfoxide reductase from neisseria meningitidis in complex with its substrate

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 126
  • Norm. En. per Res.: -3.2678
• 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	-60.1383	-61.5568	-290.045	-411.7401	126	14	22	12129	4	12	20

Interface residues

• A-B: ALA108A, ALA108B, ALA166A, ALA166B, ALA34A, ALA34B, ALA37A, ALA37B, ALA3A, ALA3B, ALA40A, ALA40B, ALA41A, ALA41B, ALA67A, ALA67B, ALA74A, ALA74B, ARG164B, ARG60A, ARG60B, ARG77A, ARG77B, ARG82A, ARG82B, ASN35A, ASN35B, ASN38A, ASN38B, ASP28A, ASP28B, ASP31A, ASP31B, ASP58A, ASP58B, CYS109A, CYS109B, CYS75A, CYS75B, GLN165B, GLN21A, GLN21B, GLN70A, GLN70B, GLU29A, GLU29B, GLU45A, GLU45B, GLU63A, GLU63B, GLY53A, GLY53B, GLY71A, GLY71B, HIS106A, HIS106B, HIS2A, HIS2B, HIS5A, ILE107A, ILE107B, ILE22A, ILE22B, ILE78B, LEU112A, LEU112B, LEU36A, LEU36B, LEU43A, LEU43B, LEU4A, LEU4B, LEU56A, LEU56B, LEU66A, LEU66B, LEU73A, LEU73B, LYS44A, LYS44B, MET1A, MET1B, PHE50A, PHE50B, PHE54A, PHE54B, PHE69A, PHE69B, PHE6A, PHE6B, PRO68A, PRO68B, PRO72A, PRO72B, SER110A, SER110B, SER111A, SER111B, SER163B, SER61B, THR30A, THR30B, THR39A, THR39B, THR76A, THR76B, TRP32A, TRP32B, TRP51A, TRP51B, TYR55A, TYR55B, VAL167A, VAL167B, VAL25A, VAL25B, VAL26A, VAL26B, VAL33A, VAL33B, VAL42A, VAL42B, VAL52A, VAL52B, VAL65A, VAL65B