2EF5

crystal structure of the arginase from thermus thermophilus

• Total interactions analyzed: 15
• Total true interactions: 11
• Strongest Interaction:
  • Chains: A-F
  • Int. Res.: 75
  • Norm. En. per Res.: -2.9335
• Hub Node: A(3)

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-D	-5.976	-11.139	-10.3345	-27.4495	22	0	0	685	1	13	13
A-F	-36.7081	-20.7104	-162.597	-220.0155	75	10	4	6340	8	26	31
A-G	0.0	30.5604	-16.1429	14.4175	18	0	0	680	0	13	12
B-D	0.0	7.8796	-0.1226	7.7571	4	0	0	19	0	2	5
B-E	-28.358	-23.1507	-162.135	-213.6437	78	8	4	6337	10	26	30
B-F	-2.6001	-43.7306	5.3264	-41.0043	32	12	0	1353	2	19	13
D-E	-16.3943	-18.77	-33.8225	-68.9868	29	4	1	1610	1	10	9
D-F	0.0	0.0	-0.0019	-0.0019	2	0	0	1	0	0	0
E-F	0.0	0.0	-0.5872	-0.5872	10	0	0	85	0	6	7
E-G	-20.2668	-73.1482	151.703	58.288	74	86	0	5723	5	28	35
F-G	-13.6483	11.2112	-13.9988	-16.4359	26	9	0	1804	2	16	11

Interface residues

• A-D: ALA157D, ARG111D, ARG112D, ARG156D, ARG199A, ASP159D, ASP162D, GLN209A, GLU202A, GLU203A, GLU252A, GLY145D, GLY210D, ILE249A, LEU205A, LEU211D, LYS161D, LYS206A, PRO160D, SER144D, SER253A, VAL158D
• A-F: ALA120A, ALA122A, ALA198F, ALA201F, ALA243A, ARG169A, ARG177A, ARG185A, ARG194A, ARG199F, ARG241F, ARG273F, ARG289F, ASP172A, ASP193A, ASP223A, GLU175A, GLU181A, GLU191A, GLU202F, GLU242A, GLU242F, GLU248F, GLU252F, GLY167A, GLY183A, GLY196A, GLY196F, GLY236A, GLY237A, HIS121A, HIS190A, HIS244F, ILE200A, ILE249F, ILE290F, LEU165A, LEU171A, LEU178A, LEU179A, LEU195A, LEU205F, LEU222A, LEU226F, LEU238A, LEU245F, LEU246F, LEU250F, LYS176A, LYS180A, LYS288F, MET189A, MET247F, MET277F, PHE291F, PRO173A, PRO235A, SER170A, SER284F, THR188A, THR225A, THR225F, THR239A, THR239F, TYR187A, TYR240A, TYR240F, VAL168A, VAL184A, VAL186A, VAL192A, VAL197A, VAL197F, VAL221A, VAL234A
• A-G: ARG177A, ARG177G, GLU128A, GLU128G, GLU181A, GLU181G, GLY174A, GLY174G, LEU178A, LEU178G, LYS176G, PRO127A, PRO127G, PRO173A, PRO173G, THR126A, THR129A, THR129G
• B-D: ARG289D, ASP38B, GLU2D, THR42B
• B-E: ALA120E, ALA122E, ALA198B, ALA201B, ALA243B, ALA243E, ALA251B, ARG169E, ARG177E, ARG185E, ARG194E, ARG199B, ARG241B, ARG273B, ARG289B, ASP172E, ASP193E, ASP223E, GLU175E, GLU181E, GLU191E, GLU202B, GLU242B, GLU242E, GLU248B, GLU252B, GLY167E, GLY183E, GLY196B, GLY196E, GLY236E, GLY237E, HIS121E, HIS190E, HIS244B, ILE200E, ILE249B, ILE290B, LEU165E, LEU171E, LEU178E, LEU179E, LEU195E, LEU205B, LEU222E, LEU226B, LEU238E, LEU245B, LEU246B, LEU250B, LYS176E, LYS180E, LYS288B, MET189E, MET247B, MET277B, PHE291B, PRO173E, PRO235E, SER170E, SER253B, SER284B, THR188E, THR225B, THR225E, THR239B, THR239E, TYR187E, TYR240B, TYR240E, VAL168E, VAL184E, VAL186E, VAL192E, VAL197B, VAL197E, VAL221E, VAL234E
• B-F: ALA157F, ALA198B, ALA251B, ARG111F, ARG112F, ARG156F, ARG199B, ARG255B, ARG289B, ASP159F, ASP162F, GLN209B, GLN209F, GLN257B, GLU202B, GLU252B, GLY110F, GLY210B, GLY210F, GLY254B, HIS207B, ILE249B, LEU205B, LEU211B, LEU211F, LEU250B, LYS161F, LYS206B, LYS78F, PRO160F, PRO212B, SER253B
• D-E: ALA82D, ALA83D, ARG109D, ARG111D, ARG177E, ARG3D, ARG80D, ASN125E, ASN134E, ASP172E, GLU128E, GLU2D, GLU79D, GLU86D, GLY133E, GLY174E, GLY87D, LEU178E, LEU64E, LEU84D, MET138E, PRO127E, PRO173E, PRO85D, SER130E, SER132E, THR126E, THR129E, VAL88D
• D-F: ARG199F, GLN209D
• E-F: ARG111F, ARG112F, ARG194E, ARG199E, GLN209F, GLU86F, GLY210F, LEU195E, LEU211F, LYS180E
• E-G: ALA105G, ALA107E, ALA108E, ALA108G, ALA157G, ALA182G, ALA251E, ARG109E, ARG109G, ARG111E, ARG111G, ARG112E, ARG112G, ARG150G, ARG156G, ARG185G, ARG255E, ARG3E, ARG71G, ASP159G, ASP162E, ASP162G, GLN209E, GLN209G, GLN257E, GLU153G, GLU252E, GLU2E, GLU86E, GLY110E, GLY110G, GLY114E, GLY145G, GLY183G, GLY210E, GLY210G, GLY254E, GLY87E, HIS207E, HIS207G, LEU143G, LEU146G, LEU151G, LEU205E, LEU208E, LEU208G, LEU211E, LEU211G, LEU213E, LEU286E, LEU75G, LYS161G, LYS206E, LYS206G, LYS78G, PHE124G, PHE155G, PHE89E, PRO149G, PRO160G, PRO212E, PRO85E, SER144G, SER253E, THR152G, TYR41E, VAL113E, VAL142G, VAL154G, VAL158G, VAL163G, VAL184G, VAL256E, VAL88E
• F-G: ARG150G, ARG3F, ARG71G, ASP38F, GLU128G, GLU153G, GLU2F, GLU34F, GLU37F, GLU44F, GLU68G, GLY40F, GLY87F, HIS148G, LEU151G, LEU36F, LEU39F, LEU64G, LEU67G, PRO127G, PRO149G, THR42F, TYR41F, VAL154G, VAL43F, VAL88F