3B77

crystal structure of a ph domain containing bacterial protein (exig_2160) from exiguobacterium sibiricum 255-15 at 2.42 a resolution

• Total interactions analyzed: 15
• Total true interactions: 11
• Strongest Interaction:
  • Chains: B-C
  • Int. Res.: 142
  • Norm. En. per Res.: -3.8797
• 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-B	-30.6818	-30.0162	-459.903	-520.601	146	18	13	17959	7	53	58
A-C	0.0	0.0	-7.6874	-7.6874	14	0	2	536	0	0	2
A-E	0.0	0.0	-0.0356	-0.0356	3	0	0	21	0	0	0
B-C	-42.4543	-58.0507	-450.415	-550.92	142	16	13	17580	8	54	59
B-E	0.0	0.0	-0.5599	-0.5599	7	0	0	107	0	6	8
B-F	0.0	0.0	-0.2258	-0.2258	2	0	0	14	0	3	0
C-D	-6.8233	-7.1669	-33.0464	-47.0367	21	7	0	1703	0	8	3
C-E	0.0	0.0	-1.17	-1.17	13	0	0	181	0	8	4
D-E	-40.1592	-45.0983	-464.509	-549.7665	148	20	14	17926	7	57	56
D-F	0.0	0.0	-5.6165	-5.6165	13	0	1	439	0	1	2
E-F	-48.6004	-50.7959	-447.214	-546.6103	145	22	15	18012	5	56	55

Interface residues

• A-B: ALA128A, ALA131A, ALA146A, ALA28B, ALA29B, ALA80B, ALA92A, ARG161A, ARG161B, ARG72B, ARG76B, ASN147A, ASN147B, ASN151A, ASN151B, ASN166A, ASN166B, ASN190B, ASN203A, ASP124A, ASP164A, ASP164B, ASP173A, ASP173B, ASP180A, ASP180B, ASP30B, ASP31B, ASP37B, ASP63B, ASP96A, ASP98A, GLN162A, GLN169A, GLN169B, GLN176A, GLN176B, GLN183B, GLU100A, GLU120A, GLU134A, GLU138A, GLU144A, GLU177A, GLU177B, GLU199A, GLU36B, GLU39B, GLU90A, GLY139A, GLY158A, GLY158B, GLY159A, GLY159B, GLY163A, GLY163B, GLY184B, GLY38B, GLY93A, HIS152A, HIS185A, HIS185B, HIS35B, HIS61B, HIS81B, HIS86A, ILE156A, ILE156B, ILE202A, LEU119A, LEU130A, LEU143A, LEU143B, LEU150A, LEU150B, LEU157A, LEU157B, LEU160A, LEU160B, LEU174A, LEU174B, LEU182A, LEU182B, LEU34B, LEU57B, LEU62B, LEU74B, LYS102A, LYS116A, LYS123A, LYS127A, LYS135A, LYS141A, LYS172A, LYS172B, LYS188A, LYS192B, LYS200A, LYS71B, PHE145A, PHE171A, PHE171B, PHE179A, PHE179B, PHE197A, PHE89A, PRO168B, PRO78B, SER148A, SER149A, SER153A, SER153B, SER175A, SER175B, SER178A, SER178B, SER70B, THR155A, THR155B, THR170A, THR170B, THR91A, THR94A, TRP181A, TRP181B, TRP189A, TYR126A, TYR137A, TYR186B, TYR187B, TYR201A, TYR32B, TYR75B, TYR77B, TYR82B, VAL122A, VAL154A, VAL154B, VAL167A, VAL167B, VAL33B, VAL60B, VAL73B, VAL87A, VAL95A, VAL99A
• A-C: ARG161A, GLN162C, HIS152A, ILE156A, LEU157A, LEU160A, LEU174C, PHE171C, PRO168C, SER149A, SER153A, SER175C, THR170C, VAL167C
• A-E: LYS135A, LYS200A, VAL95E
• B-C: ALA128B, ALA131B, ALA146B, ALA28C, ALA29C, ALA80C, ALA92B, ARG161B, ARG161C, ARG72C, ARG76C, ASN147B, ASN147C, ASN151B, ASN151C, ASN166B, ASN166C, ASN190C, ASN203B, ASP124B, ASP164B, ASP173B, ASP173C, ASP180B, ASP180C, ASP30C, ASP31C, ASP37C, ASP63C, ASP96B, ASP98B, GLN162C, GLN169B, GLN169C, GLN176B, GLN176C, GLN183C, GLU100B, GLU120B, GLU134B, GLU138B, GLU144B, GLU177B, GLU177C, GLU199B, GLU36C, GLU39C, GLU90B, GLY139B, GLY158B, GLY158C, GLY159B, GLY159C, GLY163B, GLY184C, GLY38C, GLY93B, HIS152B, HIS185B, HIS185C, HIS35C, HIS61C, HIS81C, HIS86B, ILE156B, ILE156C, ILE202B, LEU119B, LEU130B, LEU143B, LEU143C, LEU150B, LEU150C, LEU157B, LEU157C, LEU160B, LEU160C, LEU174B, LEU174C, LEU182B, LEU182C, LEU34C, LEU57C, LEU62C, LEU74C, LYS102B, LYS123B, LYS127B, LYS135B, LYS141B, LYS172B, LYS172C, LYS188B, LYS192C, LYS200B, LYS71C, PHE145B, PHE171B, PHE171C, PHE179B, PHE179C, PHE89B, PRO168C, PRO78C, SER148B, SER149B, SER153B, SER153C, SER175B, SER175C, SER178B, SER178C, SER70C, THR155B, THR155C, THR170B, THR170C, THR91B, THR94B, TRP181B, TRP181C, TRP189B, TYR126B, TYR137B, TYR186C, TYR187C, TYR201B, TYR32C, TYR75C, TYR77C, TYR82C, VAL122B, VAL154B, VAL154C, VAL167B, VAL167C, VAL33C, VAL60C, VAL73C, VAL87B, VAL95B, VAL99B
• B-E: GLN183B, LEU97E, LYS188B, LYS48E, THR49E, TRP189B, TYR187B
• B-F: HIS1B, PHE145F
• C-D: ALA146C, ALA92D, ASP180C, ASP96D, ASP98D, GLN183C, GLU177C, GLY184C, GLY93D, HIS185C, LEU143C, LEU182C, LEU97D, LYS116D, LYS188C, THR94D, TRP181C, TRP189C, TYR186C, TYR187C, VAL95D
• C-E: ASP180C, GLN176C, GLN17E, GLN183C, GLY184C, HIS185C, LYS172C, LYS188C, LYS48E, SER70E, THR49E, TRP181C, TYR187C
• D-E: ALA128D, ALA131D, ALA133D, ALA146D, ALA28E, ALA29E, ALA58E, ALA80E, ALA92D, ARG161D, ARG161E, ARG72E, ARG76E, ARG85D, ASN147D, ASN147E, ASN151D, ASN151E, ASN166E, ASN190E, ASN203D, ASP124D, ASP164D, ASP173D, ASP173E, ASP180D, ASP180E, ASP30E, ASP31E, ASP37E, ASP63E, ASP96D, ASP98D, GLN140D, GLN162E, GLN169D, GLN169E, GLN176D, GLN176E, GLN183E, GLU100D, GLU120D, GLU134D, GLU138D, GLU144D, GLU177D, GLU177E, GLU199D, GLU36E, GLU39E, GLU90D, GLY139D, GLY158D, GLY158E, GLY159D, GLY159E, GLY163D, GLY163E, GLY184E, GLY38E, GLY93D, HIS152D, HIS185D, HIS185E, HIS35E, HIS61E, HIS81E, HIS86D, ILE156D, ILE156E, ILE202D, LEU119D, LEU130D, LEU143D, LEU143E, LEU150D, LEU150E, LEU157D, LEU157E, LEU160D, LEU160E, LEU174D, LEU174E, LEU182D, LEU182E, LEU34E, LEU57E, LEU62E, LEU74E, LYS102D, LYS116D, LYS123D, LYS127D, LYS135D, LYS141D, LYS172D, LYS172E, LYS188D, LYS192E, LYS200D, LYS71E, PHE145D, PHE171D, PHE171E, PHE179D, PHE179E, PHE197D, PHE89D, PRO168E, PRO78E, SER148D, SER149D, SER153D, SER153E, SER175D, SER175E, SER178D, SER178E, SER70E, THR155D, THR155E, THR170D, THR170E, THR91D, THR94D, TRP181D, TRP181E, TRP189D, TYR126D, TYR137D, TYR186E, TYR187E, TYR201D, TYR32E, TYR75E, TYR77E, TYR82E, VAL122D, VAL154D, VAL154E, VAL167D, VAL167E, VAL33E, VAL60E, VAL73E, VAL87D, VAL95D, VAL99D
• D-F: ARG161D, ARG161F, GLN162F, HIS152D, ILE156D, LEU157D, LEU160D, LEU174F, PHE171F, PRO168F, SER149D, SER153D, VAL167F
• E-F: ALA128E, ALA131E, ALA133E, ALA146E, ALA28F, ALA29F, ALA80F, ALA92E, ARG161E, ARG161F, ARG72F, ARG76F, ASN147E, ASN147F, ASN151E, ASN151F, ASN166E, ASN166F, ASN190F, ASN203E, ASP124E, ASP164F, ASP173E, ASP173F, ASP180E, ASP180F, ASP30F, ASP31F, ASP37F, ASP63F, ASP96E, ASP98E, GLN140E, GLN162E, GLN162F, GLN169E, GLN169F, GLN176E, GLN176F, GLN183F, GLU100E, GLU120E, GLU134E, GLU138E, GLU144E, GLU177E, GLU177F, GLU36F, GLU39F, GLU90E, GLY139E, GLY158E, GLY158F, GLY159E, GLY159F, GLY163E, GLY163F, GLY184F, GLY38F, GLY64F, GLY93E, HIS152E, HIS185E, HIS185F, HIS35F, HIS61F, HIS81F, HIS86E, ILE156E, ILE156F, ILE202E, LEU119E, LEU130E, LEU143E, LEU143F, LEU150E, LEU150F, LEU157E, LEU157F, LEU160E, LEU160F, LEU174E, LEU174F, LEU182E, LEU182F, LEU34F, LEU57F, LEU62F, LEU74F, LYS102E, LYS123E, LYS127E, LYS135E, LYS141E, LYS172E, LYS172F, LYS188E, LYS192F, LYS200E, LYS71F, PHE145E, PHE171E, PHE171F, PHE179E, PHE179F, PHE197E, PHE89E, PRO168F, PRO78F, SER148E, SER149E, SER153E, SER153F, SER175E, SER175F, SER178E, SER178F, THR155E, THR155F, THR170E, THR170F, THR91E, THR94E, TRP181E, TRP181F, TRP189E, TYR126E, TYR137E, TYR186F, TYR187F, TYR201E, TYR32F, TYR75F, TYR77F, TYR82F, VAL122E, VAL154E, VAL154F, VAL167F, VAL33F, VAL60F, VAL73F, VAL87E, VAL95E, VAL99E