3MF1

crystal structure of class ii aars homologue (bll0957) complexed with an analogue of glycyl adenylate

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 224
  • Norm. En. per Res.: -0.7964
• 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	-129.839	-58.587	10.043	-178.383	224	27	22	27799	9	64	51

Interface residues

• A-B: ALA104B, ALA105A, ALA105B, ALA111A, ALA122A, ALA122B, ALA130A, ALA130B, ALA154A, ALA154B, ALA155A, ALA155B, ALA38A, ALA38B, ALA41A, ALA41B, ALA64A, ALA64B, ALA74A, ALA74B, ARG100B, ARG141A, ARG141B, ARG159A, ARG159B, ARG160A, ARG160B, ARG173A, ARG173B, ARG220A, ARG39A, ARG39B, ARG58A, ARG58B, ARG66A, ARG66B, ARG73A, ARG73B, ASN103A, ASN103B, ASN87A, ASN87B, ASP110A, ASP110B, ASP114A, ASP114B, ASP123A, ASP123B, ASP152A, ASP152B, ASP156A, ASP156B, ASP285A, ASP285B, ASP34A, ASP34B, CYS157A, CYS157B, CYS91A, CYS91B, CYS93A, CYS93B, GLN170A, GLN170B, GLN75A, GLN75B, GLU101B, GLU161A, GLU161B, GLU44A, GLU44B, GLU48A, GLU48B, GLU63A, GLU63B, GLU77A, GLU77B, GLU99A, GLU99B, GLY219A, GLY222A, GLY32A, GLY32B, GLY35A, GLY35B, GLY80A, GLY80B, GLY90A, GLY90B, GLY94A, GLY94B, GLY97A, GLY97B, HIS29A, HIS29B, HIS96A, HIS96B, ILE102A, ILE102B, ILE137A, ILE137B, LEU119A, LEU119B, LEU124A, LEU124B, LEU126A, LEU126B, LEU169A, LEU169B, LEU27A, LEU27B, LEU42A, LEU42B, LEU65A, LEU65B, LEU76A, LEU76B, LEU82A, LEU82B, LEU88A, LEU88B, LEU89A, LEU89B, LEU95A, LEU95B, LYS225A, LYS78A, LYS78B, LYS83A, LYS83B, MET31A, MET31B, MET71A, MET71B, PHE109A, PHE109B, PHE151A, PHE151B, PHE158A, PHE158B, PHE172A, PHE172B, PHE218A, PHE28A, PHE28B, PHE67A, PHE67B, PHE85A, PHE85B, PRO121A, PRO121B, PRO133A, PRO133B, PRO136A, PRO136B, PRO162A, PRO162B, PRO68A, PRO68B, PRO69A, PRO69B, PRO86A, PRO86B, SER107A, SER107B, SER118A, SER120A, SER120B, SER127A, SER127B, SER140A, SER140B, SER171A, SER171B, SER30A, SER30B, SER33A, SER33B, SER45A, SER45B, SER72A, SER72B, SER79A, SER79B, SER84A, SER84B, THR116A, THR116B, THR117A, THR117B, THR40A, THR40B, THR55B, THR62A, THR62B, THR98B, TRP115A, TRP115B, TRP265A, TYR132A, TYR132B, TYR37A, TYR37B, TYR43A, TYR43B, TYR81A, TYR81B, VAL106A, VAL106B, VAL125A, VAL125B, VAL134A, VAL134B, VAL153A, VAL153B, VAL221A, VAL36A, VAL36B, VAL47A, VAL47B, VAL70A, VAL70B, VAL92A, VAL92B