3FAC

crystal structure of rhodobacter sphaeroides protein rsp_2168. northeast structural genomics target rhr83.

• Total interactions analyzed: 28
• Total true interactions: 11
• Strongest Interaction:
  • Chains: B-H
  • Int. Res.: 115
  • Norm. En. per Res.: -3.6986
• Hub Node: A(5)

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	0.0	0.0	-0.3147	-0.3147	4	0	0	39	0	1	0
A-C	-40.5844	37.2033	-415.798	-419.1791	118	34	0	14843	2	20	56
A-E	0.0	0.0	-0.0064	-0.0064	2	0	0	5	0	1	2
A-F	-25.2043	-11.4045	-82.0234	-118.6321	41	4	2	3251	2	18	15
A-H	0.0	1.2856	-78.3057	-77.02	60	7	3	4027	0	21	27
B-D	0.0	0.0	-0.498	-0.498	9	0	0	104	0	3	4
B-E	-22.6488	-10.9594	-82.8046	-116.4128	43	7	2	3107	2	17	15
B-H	-23.5836	33.9911	-435.742	-425.3344	115	25	0	14681	1	19	58
C-F	0.0	0.0	-0.554	-0.554	5	0	0	105	0	2	4
C-G	-34.2915	-12.5248	-89.3758	-136.1922	45	4	2	3431	3	19	15
D-H	-26.6571	-9.8996	-92.2607	-128.8173	44	6	2	3502	3	19	15

Interface residues

• A-B: ARG71B, GLU86A, LEU43A, PRO85A
• A-C: ALA36A, ALA36C, ALA93A, ALA93C, ALA9A, ALA9C, ARG101A, ARG101C, ARG24A, ARG24C, ARG25A, ARG25C, ARG32A, ARG32C, ARG33A, ARG33C, ARG34A, ARG34C, ARG71A, ARG71C, ASN91A, ASN91C, ASN99A, ASN99C, ASP102A, ASP102C, ASP27A, ASP27C, CYS26A, CYS26C, CYS28A, CYS28C, CYS31A, CYS31C, CYS5A, CYS5C, CYS70A, CYS70C, CYS73A, CYS73C, CYS7A, CYS7C, GLN59A, GLN59C, GLU105A, GLU105C, GLU96A, GLU96C, GLY104A, GLY104C, GLY35A, GLY35C, GLY3A, GLY3C, GLY61A, GLY61C, GLY74A, GLY74C, GLY8A, GLY8C, GLY97A, GLY97C, HIS67A, HIS67C, HIS6A, HIS6C, ILE37A, ILE37C, ILE75A, ILE75C, ILE94A, ILE94C, LEU103A, LEU103C, LEU57A, LEU57C, LEU95A, LEU95C, LYS2A, LYS2C, PHE30A, PHE30C, PHE60A, PHE60C, PHE69A, PHE69C, PRO100A, PRO100C, PRO107A, PRO107C, SER29A, SER29C, THR109A, THR109C, THR4A, THR4C, THR56A, THR56C, THR72A, THR72C, THR77A, THR77C, TRP108A, TRP108C, TRP68A, TRP68C, TYR58A, TYR58C, TYR76A, TYR76C, VAL106A, VAL106C, VAL10A, VAL10C, VAL92A, VAL92C, VAL98A, VAL98C
• A-E: ALA21E, GLU86A
• A-F: ALA21A, ALA23A, ALA52F, ALA9F, ARG101A, ARG47F, ARG50F, ARG71F, ASN54F, ASN99A, ASP102A, GLU11F, GLU13A, GLU15A, GLU53F, GLU96A, GLY104A, GLY19A, GLY51F, GLY97A, ILE12F, LEU103A, LEU16A, LEU43F, LEU46F, LEU55F, LEU57F, LEU95A, LYS2A, LYS66F, MET1A, PHE20A, PRO100A, SER44F, TRP68F, TYR88F, VAL10F, VAL48F, VAL49F, VAL92A, VAL98A
• A-H: ALA52A, ALA52H, ALA65H, ALA9H, ARG47A, ARG47H, ARG50A, ARG50H, ARG63A, ARG63H, ARG71A, ARG71H, ASN54A, ASN54H, ASP45A, GLN59A, GLN59H, GLN80A, GLU13A, GLU13H, GLU53A, GLU53H, GLU86A, GLY51A, GLY51H, GLY61A, HIS78A, HIS78H, ILE12A, ILE12H, LEU43A, LEU43H, LEU46A, LEU46H, LEU55A, LEU55H, LEU57A, LEU57H, LYS66A, LYS66H, PHE60H, PRO85A, SER44A, SER44H, THR56A, THR56H, THR62A, THR62H, THR64A, THR64H, TRP68A, TRP68H, TYR58A, TYR58H, TYR88A, TYR88H, VAL48A, VAL48H, VAL49A, VAL49H
• B-D: ALA52D, ARG32B, ARG33B, ARG47D, ARG50D, ASP27B, GLY51D, TRP108B, VAL49D
• B-E: ALA21E, ALA52B, ALA9B, ARG101E, ARG47B, ARG50B, ARG71B, ASN54B, ASN99E, ASP102E, GLU11B, GLU13B, GLU13E, GLU15E, GLU53B, GLU96E, GLY104E, GLY19E, GLY51B, GLY97E, HIS78B, ILE12B, LEU103E, LEU16E, LEU43B, LEU46B, LEU55B, LEU57B, LEU95E, LYS2E, LYS66B, MET1E, PHE20E, PRO100E, SER44B, TRP68B, TYR88B, VAL10B, VAL14E, VAL48B, VAL49B, VAL92E, VAL98E
• B-H: ALA36B, ALA36H, ALA93B, ALA93H, ALA9H, ARG101B, ARG101H, ARG24B, ARG24H, ARG25B, ARG25H, ARG32B, ARG32H, ARG33B, ARG33H, ARG34B, ARG34H, ARG71B, ARG71H, ASN91B, ASN91H, ASN99B, ASN99H, ASP102B, ASP102H, ASP27B, ASP27H, CYS26B, CYS26H, CYS28B, CYS28H, CYS31B, CYS31H, CYS5B, CYS5H, CYS70B, CYS70H, CYS73B, CYS73H, CYS7B, CYS7H, GLN59B, GLN59H, GLU105B, GLU105H, GLU96B, GLU96H, GLY104B, GLY104H, GLY35B, GLY35H, GLY3B, GLY3H, GLY61B, GLY61H, GLY74B, GLY74H, GLY8B, GLY8H, GLY97B, GLY97H, HIS67B, HIS67H, HIS6B, HIS6H, ILE37B, ILE37H, ILE75B, ILE75H, ILE94B, ILE94H, LEU103B, LEU103H, LEU57B, LEU57H, LEU95B, LEU95H, LYS2H, PHE30B, PHE30H, PHE60B, PHE60H, PHE69B, PHE69H, PRO100B, PRO100H, PRO107B, PRO107H, SER29B, SER29H, THR109B, THR4B, THR4H, THR56B, THR56H, THR72B, THR72H, THR77B, THR77H, TRP108B, TRP108H, TRP68B, TRP68H, TYR58B, TYR58H, TYR76B, TYR76H, VAL106B, VAL106H, VAL10B, VAL10H, VAL92B, VAL92H, VAL98B, VAL98H
• C-F: ARG32C, ARG50F, ASP27C, GLY51F, VAL49F
• C-G: ALA21G, ALA23G, ALA52C, ALA9C, ARG101G, ARG47C, ARG50C, ARG71C, ASN54C, ASN99G, ASP102G, GLN59C, GLU11C, GLU13C, GLU13G, GLU15G, GLU53C, GLU96G, GLY104G, GLY19G, GLY51C, GLY97G, HIS78C, ILE12C, LEU103G, LEU16G, LEU43C, LEU46C, LEU55C, LEU57C, LEU95G, LYS2G, LYS66C, MET1G, PHE20G, PRO100G, SER44C, TRP68C, TYR88C, VAL10C, VAL14G, VAL48C, VAL49C, VAL92G, VAL98G
• D-H: ALA21H, ALA23H, ALA52D, ALA9D, ARG101H, ARG47D, ARG50D, ARG71D, ASN54D, ASN99H, ASP102H, GLN59D, GLU11D, GLU13H, GLU15H, GLU53D, GLU96H, GLY104H, GLY19H, GLY51D, GLY97H, ILE12D, LEU103H, LEU16H, LEU43D, LEU46D, LEU55D, LEU57D, LEU95H, LYS2H, LYS66D, MET1H, PHE20H, PRO100H, SER44D, THR4H, TRP68D, TYR88D, VAL10D, VAL14H, VAL48D, VAL49D, VAL92H, VAL98H