2Y1R

structure of meca121 & clpc n-domain complex

• Total interactions analyzed: 120
• Total true interactions: 38
• Strongest Interaction:
  • Chains: F-G
  • Int. Res.: 30
  • Norm. En. per Res.: -5.2583
• Hub Node: B(6)

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	-22.0432	-54.1335	-66.6259	-142.8026	33	16	0	3450	10	38	38
A-E	0.0	54.0164	-62.2352	-8.2188	65	30	0	4768	0	44	44
A-F	0.0	0.0	-0.0822	-0.0822	2	0	0	4	0	3	2
A-I	-31.9234	-3.6333	-210.071	-245.6277	78	25	3	7688	0	29	20
A-K	0.0	0.0	-0.5483	-0.5483	4	0	0	40	0	2	0
B-C	-20.1246	-69.186	-67.2789	-156.5895	30	11	0	3201	10	38	37
B-E	0.0	0.0	-0.0153	-0.0153	2	0	0	1	0	2	2
B-F	-5.3288	-7.3869	122.236	109.5202	42	76	1	4359	0	18	17
B-J	-41.9352	-8.1946	-221.641	-271.7708	79	31	3	8110	0	29	22
B-K	-35.9858	20.8784	-98.3646	-113.472	32	10	0	3121	0	12	12
B-P	-12.7312	10.6315	-5.5809	-7.6806	9	2	0	206	0	4	3
C-D	0.0	0.0	-0.02	-0.02	10	0	0	25	0	0	2
C-I	0.0	0.0	-1.8648	-1.8648	7	0	0	94	0	2	1
C-J	-27.5238	24.6085	-91.6307	-94.546	34	9	0	3125	0	12	12
C-K	-37.8238	-5.2246	-196.026	-239.0744	75	19	3	7308	1	28	20
D-I	-27.5674	23.5996	-91.6309	-95.5987	33	10	0	3074	0	12	12
D-J	0.0	0.0	-1.5823	-1.5823	7	0	0	74	0	2	1
D-L	0.0	0.0	-0.0791	-0.0791	4	0	0	25	0	0	0
E-F	0.0	0.0	-0.002	-0.002	6	0	0	6	0	0	2
E-H	-23.8421	-55.2371	-68.4688	-147.548	33	14	0	3426	10	39	38
E-M	-35.7511	-1.3274	-204.826	-241.9045	75	25	3	7579	0	28	20
E-O	0.0	0.0	-0.9486	-0.9486	6	0	0	63	0	2	1
E-P	-31.4295	20.5869	-95.5964	-106.439	33	10	0	3148	0	12	12
F-G	-20.6743	-73.0456	-64.03	-157.7499	30	12	0	3181	10	37	37
F-N	-42.6497	-3.0468	-222.26	-267.9566	72	35	3	7909	0	28	20
F-O	-27.522	22.7217	-89.564	-94.3643	32	10	0	3013	0	12	12
F-P	0.0	0.0	-1.1786	-1.1786	5	0	0	66	0	2	1
G-H	0.0	0.0	-0.0076	-0.0076	8	0	0	12	0	0	2
G-M	0.0	0.0	-1.7379	-1.7379	7	0	0	99	0	2	1
G-N	-25.3371	27.7998	-93.86	-91.3973	34	12	0	3223	0	12	12
G-O	-41.0983	-1.5854	-207.42	-250.1037	75	26	3	7780	0	29	20
H-M	-29.8761	21.6336	-91.4871	-99.7295	31	9	0	3001	0	12	12
H-N	0.0	0.0	-0.6017	-0.6017	5	0	0	45	0	2	0
H-P	-38.8894	-1.9326	-198.969	-239.791	76	22	3	7334	0	29	19
I-K	-30.0607	37.5203	-155.622	-148.1624	59	11	3	5972	0	10	25
J-L	-8.9302	4.0126	-69.3072	-74.2247	26	7	1	2332	0	2	5
M-O	-37.234	40.4929	-154.247	-150.9881	54	12	3	5857	0	10	25
N-P	-39.891	38.2041	-168.569	-170.2559	59	14	3	6186	0	10	25

Interface residues

• A-D: ARG114A, ARG114D, ARG83A, ARG83D, ARG96A, ARG96D, ASP93A, ASP93D, GLU115A, GLU115D, GLU117A, GLU117D, GLU89A, GLU89D, GLU94A, GLU94D, GLY111A, GLY116A, GLY116D, GLY99A, GLY99D, LEU90A, LEU90D, LYS86A, LYS86D, LYS97A, LYS97D, MET92A, MET92D, PRO82A, PRO82D, VAL87A, VAL87D
• A-E: ALA15A, ALA15E, ALA21A, ALA21E, ARG23A, ARG23E, ARG40A, ARG40E, ARG70A, ARG70E, GLN18A, GLN18E, GLN51E, GLN61A, GLN61E, GLN72A, GLN72E, GLN76A, GLN76E, GLU19A, GLU19E, GLU20A, GLU20E, GLU41A, GLU41E, GLU43A, GLU43E, GLU58A, GLU58E, GLU65A, GLU65E, GLU73A, GLU73E, GLY25A, GLY25E, GLY42A, GLY42E, GLY56A, GLY56E, GLY71A, GLY71E, ILE60E, LEU16A, LEU16E, LEU22A, LEU22E, LEU24A, LEU24E, LEU36A, LEU36E, LYS12A, LYS12E, LYS59A, LYS59E, LYS62A, LYS62E, MET74A, MET74E, SER57A, SER57E, SER75A, SER75E, THR77A, VAL39A, VAL39E
• A-F: GLU8A, GLU8F
• A-I: ALA120A, ALA121A, ALA186I, ALA217I, ALA84A, ARG122A, ARG132I, ARG83A, ASN125A, ASN126A, ASN146I, ASN148I, ASN177I, ASN27A, ASN28A, ASP135I, ASP138I, ASP172I, GLN125I, GLN178I, GLN72A, GLN76A, GLU115A, GLU117A, GLU137I, GLU173I, GLU174I, GLU176I, GLU184I, GLU188I, GLU32A, GLU63A, GLU65A, GLY116A, GLY118A, GLY134I, GLY30A, GLY69A, HIS26A, HIS33A, HIS79A, ILE140I, ILE181I, ILE29A, ILE34A, ILE68A, ILE78A, LEU112A, LEU131I, LEU142I, LEU145I, LEU179I, LEU182I, LEU183I, LEU67A, LYS144I, LYS213I, LYS85A, LYS86A, MET74A, PHE133I, PRO82A, SER141I, SER180I, SER218I, SER66A, THR171I, THR187I, THR31A, THR81A, TYR185I, TYR80A, VAL119A, VAL123A, VAL139I, VAL175I, VAL64A, VAL87A
• A-K: ASN159K, GLN76A, HIS79A, THR77A
• B-C: ARG114B, ARG114C, ARG83B, ARG83C, ARG96B, ARG96C, ASP93B, ASP93C, GLU115B, GLU115C, GLU117B, GLU117C, GLU89B, GLU89C, GLU94B, GLU94C, GLY111B, GLY99C, LEU90B, LEU90C, LYS86B, LYS86C, LYS97B, LYS97C, MET92B, MET92C, PRO82B, PRO82C, VAL87B, VAL87C
• B-E: GLU8B, GLU8E
• B-F: ALA15F, ALA21B, ALA21F, ARG23B, ARG23F, ARG40B, ARG40F, ARG70B, ASN27F, GLN18B, GLN61B, GLN61F, GLN72B, GLN76B, GLN76F, GLU19B, GLU19F, GLU20B, GLU20F, GLU65F, GLU73B, GLY25B, GLY25F, GLY71B, HIS26B, HIS26F, HIS33F, ILE68F, ILE78B, LEU16B, LEU16F, LEU22B, LEU22F, LEU24B, LEU24F, LEU36F, LYS62F, MET74B, SER57F, SER75B, THR77B, VAL64F
• B-J: ALA120B, ALA121B, ALA186J, ALA217J, ALA84B, ARG122B, ARG132J, ARG83B, ASN125B, ASN126B, ASN146J, ASN148J, ASN177J, ASN27B, ASN28B, ASP135J, ASP138J, ASP172J, GLN125J, GLN178J, GLN72B, GLN76B, GLU115B, GLU117B, GLU137J, GLU173J, GLU174J, GLU176J, GLU184J, GLU188J, GLU32B, GLU63B, GLU65B, GLY116B, GLY118B, GLY134J, GLY30B, GLY69B, HIS26B, HIS33B, HIS79B, ILE140J, ILE181J, ILE29B, ILE34B, ILE68B, ILE78B, LEU112B, LEU131J, LEU142J, LEU145J, LEU179J, LEU182J, LEU183J, LEU67B, LYS144J, LYS213J, LYS85B, LYS86B, MET74B, PHE133J, PRO82B, SER141J, SER143J, SER180J, SER218J, SER66B, THR171J, THR187J, THR31B, THR81B, TYR185J, TYR80B, VAL119B, VAL123B, VAL139J, VAL175J, VAL64B, VAL87B
• B-K: ALA186K, ALA95B, ARG132K, ARG160K, ARG195K, ARG5B, ARG96B, ASN159K, ASP93B, GLU158K, GLU188K, GLY134K, GLY4B, GLY99B, HIS100B, HIS107B, ILE191K, LEU131K, LEU183K, LEU98B, LYS97B, MET92B, PHE133K, PHE157K, SER101B, SER189K, SER190K, THR187K, TYR102B, TYR162K, VAL103B, VAL130K
• B-P: ARG195P, ARG9B, GLU198P, GLU41B, GLU43B, GLY42B, LYS12B, LYS48B, TYR199P
• C-D: ARG5C, ARG5D, GLN11C, GLN11D, HIS79C, HIS79D, THR77C, THR77D, TYR102C, TYR102D
• C-I: ARG160I, ASN159I, GLN76C, GLU158I, HIS79C, ILE78C, THR77C
• C-J: ALA186J, ALA95C, ARG132J, ARG160J, ARG195J, ARG5C, ARG96C, ASN159J, ASP93C, GLU158J, GLU188J, GLY134J, GLY4C, GLY99C, HIS100C, HIS107C, ILE191J, LEU131J, LEU142C, LEU183J, LEU98C, LYS97C, MET92C, PHE133J, PHE157J, SER101C, SER189J, SER190J, THR187J, TYR102C, TYR161J, TYR162J, VAL103C, VAL130J
• C-K: ALA120C, ALA121C, ALA186K, ALA217K, ALA84C, ARG122C, ARG132K, ARG83C, ASN125C, ASN126C, ASN146K, ASN148K, ASN177K, ASN27C, ASN28C, ASP135K, ASP138K, ASP172K, GLN178K, GLN72C, GLN76C, GLU115C, GLU117C, GLU137K, GLU173K, GLU174K, GLU176K, GLU184K, GLU188K, GLU32C, GLU63C, GLY116C, GLY118C, GLY134K, GLY30C, GLY69C, HIS26C, HIS33C, HIS79C, ILE140K, ILE181K, ILE29C, ILE34C, ILE68C, ILE78C, LEU112C, LEU131K, LEU142K, LEU145K, LEU179K, LEU182K, LEU183K, LEU67C, LYS144K, LYS213K, LYS85C, LYS86C, MET74C, PHE133K, PRO82C, SER141K, SER180K, SER66C, THR171K, THR187K, THR31C, THR81C, TYR185K, TYR80C, VAL119C, VAL123C, VAL139K, VAL175K, VAL64C, VAL87C
• D-I: ALA186I, ALA95D, ARG132I, ARG160I, ARG195I, ARG5D, ARG96D, ASN159I, ASP93D, GLU158I, GLU188I, GLY134I, GLY4D, GLY99D, HIS100D, HIS107D, ILE191I, LEU131I, LEU183I, LEU98D, LYS97D, MET92D, PHE133I, PHE157I, PHE3D, SER101D, SER189I, SER190I, THR187I, TYR102D, TYR162I, VAL103D, VAL130I
• D-J: ARG160J, ASN159J, GLN76D, GLU158J, HIS79D, ILE78D, THR77D
• D-L: ALA217L, GLN76D, MET74D, SER218L
• E-F: ARG5E, ARG5F, GLN11F, HIS79E, HIS79F, THR77E
• E-H: ARG114E, ARG114H, ARG83E, ARG83H, ARG96E, ARG96H, ASP93E, ASP93H, GLU115E, GLU115H, GLU117E, GLU117H, GLU89E, GLU89H, GLU94E, GLU94H, GLY111E, GLY111H, GLY116E, GLY116H, GLY99H, LEU90E, LEU90H, LYS86E, LYS86H, LYS97E, LYS97H, MET92E, MET92H, PRO82E, PRO82H, VAL87E, VAL87H
• E-M: ALA120E, ALA121E, ALA186M, ALA217M, ALA84E, ARG122E, ARG132M, ARG83E, ASN125E, ASN126E, ASN146M, ASN177M, ASN27E, ASN28E, ASP135M, ASP138M, ASP172M, GLN178M, GLN72E, GLN76E, GLU115E, GLU117E, GLU137M, GLU173M, GLU174M, GLU176M, GLU184M, GLU188M, GLU32E, GLU63E, GLU65E, GLY116E, GLY118E, GLY134M, GLY30E, GLY69E, HIS26E, HIS33E, HIS79E, ILE140M, ILE181M, ILE29E, ILE34E, ILE68E, ILE78E, LEU112E, LEU131M, LEU142M, LEU145M, LEU179M, LEU182M, LEU183M, LEU67E, LYS144M, LYS213M, LYS85E, LYS86E, MET74E, PHE133M, PRO82E, SER141M, SER180M, SER66E, THR171M, THR187M, THR31E, THR81E, TYR185M, TYR80E, VAL119E, VAL123E, VAL139M, VAL175M, VAL64E, VAL87E
• E-O: ARG160O, ASN159O, GLN76E, GLU158O, HIS79E, THR77E
• E-P: ALA186P, ALA95E, ARG132P, ARG160P, ARG195P, ARG5E, ARG96E, ASN159P, ASP93E, GLU158P, GLU188P, GLY134P, GLY4E, GLY99E, HIS100E, HIS107E, ILE191P, LEU131P, LEU183P, LEU98E, LYS97E, MET92E, PHE133P, PHE157P, SER101E, SER189P, SER190P, THR187P, TYR102E, TYR161P, TYR162P, VAL103E, VAL130P
• F-G: ARG114F, ARG114G, ARG83F, ARG83G, ARG96F, ARG96G, ASP93F, ASP93G, GLU115F, GLU115G, GLU117F, GLU117G, GLU89F, GLU89G, GLU94F, GLU94G, GLY111F, GLY116F, LEU90F, LEU90G, LYS86F, LYS86G, LYS97F, LYS97G, MET92F, MET92G, PRO82F, PRO82G, VAL87F, VAL87G
• F-N: ALA120F, ALA121F, ALA186N, ALA84F, ARG122F, ARG132N, ARG83F, ASN125F, ASN126F, ASN177N, ASN27F, ASN28F, ASP135N, ASP138N, ASP172N, GLN125N, GLN178N, GLN76F, GLU115F, GLU117F, GLU137N, GLU173N, GLU174N, GLU176N, GLU184N, GLU188N, GLU32F, GLU63F, GLU65F, GLY116F, GLY118F, GLY134N, GLY30F, HIS26F, HIS33F, HIS79F, ILE140N, ILE181N, ILE29F, ILE34F, ILE68F, ILE78F, LEU112F, LEU131N, LEU142N, LEU145N, LEU179N, LEU182N, LEU183N, LEU67F, LYS144N, LYS213N, LYS85F, LYS86F, PHE133N, PRO82F, SER141N, SER143N, SER180N, SER66F, THR171N, THR187N, THR31F, THR81F, TYR185N, TYR80F, VAL119F, VAL123F, VAL139N, VAL175N, VAL64F, VAL87F
• F-O: ALA186O, ALA95F, ARG132O, ARG160O, ARG195O, ARG5F, ARG96F, ASN159O, ASP93F, GLU158O, GLU188O, GLY134O, GLY4F, GLY99F, HIS100F, HIS107F, ILE191O, LEU183O, LEU98F, LYS97F, MET92F, PHE133O, PHE157O, PHE3F, SER101F, SER189O, SER190O, THR187O, TYR102F, TYR162O, VAL103F, VAL130O
• F-P: ASN159P, GLN76F, GLU158P, HIS79F, THR77F
• G-H: ARG5G, ARG5H, GLN11G, GLN11H, HIS79G, HIS79H, THR77G, THR77H
• G-M: ARG160M, ASN159M, GLN76G, GLU158M, HIS79G, ILE78G, THR77G
• G-N: ALA186N, ALA95G, ARG132N, ARG160N, ARG195N, ARG5G, ARG96G, ASN159N, ASP93G, GLU158N, GLU188N, GLY134N, GLY4G, GLY99G, HIS100G, HIS107G, ILE191N, LEU131N, LEU142G, LEU183N, LEU98G, LYS97G, MET92G, PHE133N, PHE157N, SER101G, SER189N, SER190N, THR187N, TYR102G, TYR161N, TYR162N, VAL103G, VAL130N
• G-O: ALA120G, ALA121G, ALA186O, ALA217O, ALA84G, ARG122G, ARG132O, ARG83G, ASN125G, ASN126G, ASN146O, ASN177O, ASN27G, ASN28G, ASP135O, ASP138O, ASP172O, GLN178O, GLN72G, GLN76G, GLU115G, GLU117G, GLU137O, GLU173O, GLU174O, GLU176O, GLU184O, GLU188O, GLU32G, GLU63G, GLY116G, GLY118G, GLY134O, GLY30G, GLY69G, HIS26G, HIS33G, HIS79G, ILE140O, ILE181O, ILE29G, ILE34G, ILE68G, ILE78G, LEU112G, LEU131O, LEU142O, LEU145O, LEU179O, LEU182O, LEU183O, LEU67G, LYS144O, LYS213O, LYS85G, LYS86G, MET74G, PHE133O, PRO82G, SER141O, SER143O, SER180O, SER66G, THR171O, THR187O, THR31G, THR81G, TYR185O, TYR80G, VAL119G, VAL123G, VAL139O, VAL175O, VAL64G, VAL87G
• H-M: ALA186M, ALA95H, ARG132M, ARG160M, ARG195M, ARG5H, ARG96H, ASN159M, ASP93H, GLU158M, GLU188M, GLY134M, GLY4H, GLY99H, HIS100H, HIS107H, ILE191M, LEU183M, LEU98H, LYS97H, MET92H, PHE133M, PHE157M, SER101H, SER189M, SER190M, THR187M, TYR102H, TYR162M, VAL103H, VAL130M
• H-N: ASN159N, GLN76H, GLU158N, HIS79H, THR77H
• H-P: ALA120H, ALA121H, ALA186P, ALA217P, ALA84H, ARG122H, ARG132P, ARG83H, ASN125H, ASN126H, ASN146P, ASN148P, ASN177P, ASN27H, ASN28H, ASP135P, ASP138P, ASP172P, GLN178P, GLN72H, GLN76H, GLU115H, GLU117H, GLU137P, GLU173P, GLU174P, GLU176P, GLU184P, GLU188P, GLU32H, GLU63H, GLY116H, GLY118H, GLY134P, GLY30H, GLY69H, HIS26H, HIS33H, HIS79H, ILE140P, ILE181P, ILE29H, ILE34H, ILE68H, ILE78H, LEU112H, LEU131P, LEU142P, LEU145P, LEU179P, LEU182P, LEU183P, LEU67H, LYS144P, LYS213P, LYS85H, LYS86H, MET74H, PHE133P, PRO82H, SER141P, SER180P, SER218P, SER66H, THR171P, THR187P, THR31H, THR81H, TYR185P, TYR80H, VAL119H, VAL123H, VAL139P, VAL175P, VAL64H, VAL87H
• I-K: ALA217I, ALA217K, ARG160I, ARG160K, ASN159I, ASN159K, ASP135I, ASP135K, GLU137I, GLU137K, GLU158K, GLY134I, GLY134K, GLY200K, HIS207I, HIS207K, HIS215I, HIS215K, ILE140I, ILE140K, ILE203I, ILE203K, ILE204I, ILE204K, ILE212I, ILE212K, LEU154I, LEU154K, LEU202I, LEU202K, LYS144I, LYS144K, LYS201I, LYS201K, LYS213I, LYS213K, LYS214I, LYS214K, PHE136I, PHE136K, PHE157K, PHE216I, PHE216K, SER141I, SER141K, SER156I, SER156K, SER205I, SER205K, SER218I, THR211I, THR211K, TYR155I, TYR155K, TYR161I, TYR161K, TYR199K, VAL139I, VAL139K
• J-L: ALA217L, ASN159J, GLU158J, GLY200J, HIS207J, HIS215J, HIS215L, ILE140J, ILE203J, ILE204J, ILE212J, LEU154J, LEU202J, LYS201J, PHE136J, PHE157J, PHE216J, PHE216L, SER156J, SER205J, SER218L, THR211J, TYR155J, TYR161J, TYR199J, VAL139J
• M-O: ALA217M, ALA217O, ARG160M, ARG160O, ASN159M, ASN159O, ASP135M, ASP135O, GLU137M, GLU137O, GLY134M, GLY134O, HIS207M, HIS207O, HIS215M, HIS215O, ILE140M, ILE140O, ILE203M, ILE203O, ILE204M, ILE204O, ILE212M, ILE212O, LEU154M, LEU154O, LEU202M, LEU202O, LYS144M, LYS144O, LYS201M, LYS201O, LYS213M, LYS213O, LYS214M, LYS214O, PHE136M, PHE136O, PHE216M, PHE216O, SER141M, SER141O, SER156M, SER156O, SER205M, SER205O, THR211M, THR211O, TYR155M, TYR155O, TYR161M, TYR161O, VAL139M, VAL139O
• N-P: ALA217N, ALA217P, ARG160N, ARG160P, ASN159N, ASN159P, ASP135N, ASP135P, GLU137N, GLU137P, GLU158N, GLY134N, GLY134P, GLY200N, HIS207N, HIS207P, HIS215N, HIS215P, ILE140N, ILE140P, ILE203N, ILE203P, ILE204N, ILE204P, ILE212N, ILE212P, LEU154N, LEU154P, LEU202N, LEU202P, LYS144N, LYS144P, LYS201N, LYS201P, LYS213N, LYS213P, LYS214N, LYS214P, PHE136N, PHE136P, PHE157N, PHE216N, PHE216P, SER141N, SER141P, SER156N, SER156P, SER205N, SER205P, SER218P, THR211N, THR211P, TYR155N, TYR155P, TYR161N, TYR161P, TYR199N, VAL139N, VAL139P