3C6V

crystal structure of au4130/apc7354, a probable enzyme from the thermophilic fungus aspergillus fumigatus

• Total interactions analyzed: 3
• Total true interactions: 3
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 121
  • Norm. En. per Res.: -4.8944
• 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	-133.4853	-64.0636	-369.963	-567.5119	117	17	8	14000	4	30	21
A-C	-134.8465	-65.2252	-392.146	-592.2177	121	11	8	14190	4	30	20
B-C	-110.7343	-56.3474	-387.763	-554.8447	116	11	7	14432	3	32	23

Interface residues

• A-B: ALA108B, ALA119B, ALA22B, ALA36B, ALA48A, ALA63A, ALA70A, ALA88A, ARG110B, ARG136B, ARG139B, ARG3B, ARG79A, ASN116B, ASN135B, ASP100A, ASP111B, ASP76A, ASP87A, GLN23B, GLN24B, GLN27B, GLN40B, GLN46A, GLN46B, GLN57A, GLN78A, GLN7A, GLN7B, GLN80A, GLU102A, GLU107A, GLU107B, GLU16B, GLU17B, GLU45A, GLU45B, GLU56A, GLU95A, GLY117B, GLY49A, GLY54A, GLY55A, GLY98A, HIS20B, HIS42B, HIS58A, HIS68A, HIS68B, HIS8A, HIS8B, ILE115B, ILE25B, ILE44A, ILE44B, ILE53A, ILE66A, ILE66B, ILE6A, ILE6B, ILE86A, ILE99A, LEU112B, LEU118B, LEU21B, LEU5A, LEU5B, LEU64A, LEU69B, LEU83A, LEU90A, LYS114B, LYS18B, LYS84A, PHE-2A, PHE104A, PHE37B, PHE43B, PHE52A, PHE61A, PHE82A, PHE94A, PRO109B, PRO120B, PRO137B, PRO15B, PRO2B, PRO35B, PRO47A, SER19B, SER51A, SER75A, SER9A, THR106A, THR106B, THR14B, THR26B, THR50A, THR65A, THR65B, THR72A, THR74A, THR91A, TRP101A, TRP113B, TRP131B, TRP4B, TYR103A, TYR29B, TYR38B, TYR67A, TYR67B, VAL105A, VAL30B, VAL39B, VAL41B, VAL62A
• A-C: ALA108A, ALA119A, ALA22A, ALA36A, ALA48C, ALA63C, ALA70C, ALA88C, ARG110A, ARG136A, ARG139A, ARG3A, ARG71A, ARG71C, ARG79C, ASN116A, ASN135A, ASP100C, ASP111A, ASP76C, ASP87C, GLN23A, GLN24A, GLN27A, GLN40A, GLN46A, GLN46C, GLN57C, GLN78C, GLN7A, GLN7C, GLN80C, GLU102C, GLU107A, GLU107C, GLU16A, GLU17A, GLU45A, GLU45C, GLU56C, GLU95C, GLY0A, GLY117A, GLY49C, GLY54C, GLY55C, GLY81C, GLY98C, HIS20A, HIS42A, HIS58C, HIS68A, HIS68C, HIS8A, HIS8C, ILE115A, ILE25A, ILE44A, ILE44C, ILE53C, ILE66A, ILE66C, ILE6A, ILE6C, ILE86C, ILE99C, LEU112A, LEU118A, LEU21A, LEU5A, LEU5C, LEU64C, LEU69A, LEU83C, LEU90C, LYS114A, LYS18A, LYS84C, PHE-2C, PHE104C, PHE37A, PHE43A, PHE52C, PHE61C, PHE82C, PHE94C, PRO109A, PRO120A, PRO137A, PRO15A, PRO2A, PRO35A, PRO47C, SER19A, SER51C, SER75C, SER9C, THR106A, THR106C, THR14A, THR26A, THR50C, THR65A, THR65C, THR72C, THR74C, THR91C, TRP101C, TRP113A, TRP131A, TRP4A, TYR103C, TYR29A, TYR38A, TYR67A, TYR67C, VAL105C, VAL30A, VAL39A, VAL41A, VAL62C
• B-C: ALA108C, ALA119C, ALA22C, ALA36C, ALA48B, ALA63B, ALA70B, ALA88B, ARG110C, ARG136C, ARG3C, ARG71B, ARG79B, ASN116C, ASN135C, ASP100B, ASP111C, ASP76B, ASP87B, GLN23C, GLN24C, GLN27C, GLN40C, GLN46B, GLN57B, GLN78B, GLN7B, GLN7C, GLN80B, GLU102B, GLU107B, GLU107C, GLU16C, GLU17C, GLU45B, GLU45C, GLU56B, GLU95B, GLY0C, GLY117C, GLY49B, GLY54B, GLY55B, GLY98B, HIS20C, HIS42C, HIS58B, HIS68B, HIS68C, HIS8B, HIS8C, ILE115C, ILE25C, ILE44B, ILE44C, ILE53B, ILE66B, ILE66C, ILE6B, ILE6C, ILE86B, ILE99B, LEU112C, LEU118C, LEU21C, LEU5B, LEU5C, LEU64B, LEU69C, LEU83B, LEU90B, LYS114C, LYS18C, LYS84B, PHE104B, PHE104C, PHE37C, PHE43C, PHE52B, PHE61B, PHE82B, PHE94B, PRO109C, PRO120C, PRO137C, PRO15C, PRO2C, PRO35C, PRO47B, SER19C, SER51B, SER75B, SER9B, THR106B, THR106C, THR14C, THR26C, THR50B, THR65B, THR65C, THR74B, THR91B, TRP101B, TRP113C, TRP4C, TYR-3B, TYR103B, TYR29C, TYR38C, TYR67B, TYR67C, VAL105B, VAL30C, VAL39C, VAL41C, VAL62B