FMO DATABASE

FMODB ID: MN65Z

Calculation Name: 2QKO-A-Xray372

Preferred Name:

Target Type:

Ligand Name:

ligand 3-letter code:

PDB ID: 2QKO

Chain ID: A

ChEMBL ID:

UniProt ID: Q0S912

Base Structure: X-ray

Registration Date: 2023-09-20

Reference: C. Watanabe, N. Tani, K. Kamisaka, T. Honma et al., Interaction energy analysis of Apo structure dataset on FMODB, To be published.

DOI:

Apendix: None

IFIE MAP

IFIE Diagram

Modeling method

Optimization	MOE:Amber10:EHT
Restraint	OptH
Protonation	MOE:Protonate 3D
Complement	MOE:Structure Preparation
Water	No
Procedure	Auto-FMO protocol ver. 2.20220422

FMO calculation

FMO method	FMO2-MP2/6-31G(d)
Fragmentation	Auto
Number of fragment	174
LigandResidueName
LigandFragmentNumber	0
LigandCharge
Software	ABINIT-MP - Open Ver. 1 Rev. 22 / 20200603(SMP)

Total energy (hartree)

FMO2-HF: Electronic energy	-1694934.055802
FMO2-HF: Nuclear repulsion	1627661.935471
FMO2-HF: Total energy	-67272.120331
FMO2-MP2: Total energy	-67471.080131

3D Structure

Snapshot

Ligand structure

Ligand Interaction

Ligand binding energy

IFIE [kcal/mol]	PIEDA [kcal/mol]				Charge transfer value [e]
IFIE SUMIFIE SUM at MP2 level.	ESElectro static interaction energy.	EXExchange-repulsion energy.	CT+mixCharge transfer and mixing terms energy.	DI(MP2)Dispersion energy.	q(I=>J)Charge transfer value from I to J fragments.
N/A	N/A	N/A	N/A	N/A	N/A

Interactive mode: IFIE and PIEDA for fragment #1(A:5:PRO)

Summations of interaction energy for fragment #1(A:5:PRO)

IFIE [kcal/mol]	PIEDA [kcal/mol]				Charge transfer value [e]
IFIE SUMIFIE SUM at MP2 level.	ESElectro static interaction energy.	EXExchange-repulsion energy.	CT+mixCharge transfer and mixing terms energy.	DI(MP2)Dispersion energy.	q(I=>J)Charge transfer value from I to J fragments.
-4.077	2.461	0.547	-2.765	-4.32	-0.002

Interaction energy analysis for fragmet #1(A:5:PRO)

Snapshot

IFIE Diagram

Base fragment(s) of PIEDA/IFIE

Single fragment	Multi fragments
	Fragment list

Charge [e] FCHARGE : 0 / q_Mulliken : 0.020 / q_NPA : -0.014

Distance from base fragment(s) [Å]

Dist

Interaction energy by IFIE and PIEDA
[kcal/mol]

| Total | > | ES | > | EX | >
| CT+mix | > | DI(MP2) | >

Fragment charge [e]

FCHARGE q_Mulliken
q_NPA q(I=>J)

Residue

Res # RES

Sort

Graph Options

X Axis Label
Y Axis Max Y Axis Min
Display ES EX CT+mix DI(MP2)

frag_NumFragment number.	ChainChain species.	Res #Residue number.	RES3-letter code of amino acid residue, ligand and solvent molecule.	FCHARGEFormal charge [e].	q_MullikenFragment charge evaluated by Mulliken charge [e].	q_NPAFragment charge evaluated by natural population analysis(NPA) charge [e].	DISTDistance from Ligand [Å].	TotalIFIE at MP2 level [kcal/mol].	ESElectro static interaction energy by PIEDA [kcal/mol].	EXExchange-repulsion energy by PIEDA [kcal/mol].	CT+mixCharge transfer and mixing terms energy by PIEDA [kcal/mol].	DI(MP2)Dispersion energy by PIEDA [kcal/mol].	q(I=>J)Charge transfer value from I to J fragmens [e].
3	A	7	ARG	1	0.929	0.953	2.584	-0.375	2.673	0.223	-1.458	-1.813	-0.005
4	A	8	ARG	1	1.012	1.020	2.538	-3.340	-1.505	0.204	-0.654	-1.385	0.002
5	A	9	ALA	0	0.024	0.012	4.458	-0.421	-0.227	-0.001	-0.034	-0.160	0.000
6	A	10	ALA	0	0.007	0.000	6.250	0.167	0.167	0.000	0.000	0.000	0.000
7	A	11	LEU	0	-0.005	-0.002	6.872	0.065	0.065	0.000	0.000	0.000	0.000
8	A	12	VAL	0	-0.011	-0.004	8.391	-0.012	-0.012	0.000	0.000	0.000	0.000
9	A	13	ASN	0	0.016	-0.004	10.394	-0.024	-0.024	0.000	0.000	0.000	0.000
10	A	14	ALA	0	0.049	0.039	11.814	-0.003	-0.003	0.000	0.000	0.000	0.000
11	A	15	ALA	0	0.002	-0.005	12.898	-0.011	-0.011	0.000	0.000	0.000	0.000
12	A	16	ILE	0	-0.013	-0.013	13.711	-0.026	-0.026	0.000	0.000	0.000	0.000
13	A	17	GLU	-1	-0.848	-0.931	16.218	-0.011	-0.011	0.000	0.000	0.000	0.000
14	A	18	VAL	0	-0.016	-0.011	17.152	-0.005	-0.005	0.000	0.000	0.000	0.000
15	A	19	LEU	0	-0.073	-0.037	17.750	-0.005	-0.005	0.000	0.000	0.000	0.000
16	A	20	ALA	0	-0.001	0.001	20.581	-0.009	-0.009	0.000	0.000	0.000	0.000
17	A	21	ARG	1	0.846	0.938	19.818	-0.090	-0.090	0.000	0.000	0.000	0.000
18	A	22	GLU	-1	-0.917	-0.947	23.169	0.089	0.089	0.000	0.000	0.000	0.000
19	A	23	GLY	0	0.030	0.011	23.447	-0.005	-0.005	0.000	0.000	0.000	0.000
20	A	24	ALA	0	-0.064	-0.038	22.600	0.017	0.017	0.000	0.000	0.000	0.000
21	A	25	ARG	1	0.823	0.901	22.907	-0.096	-0.096	0.000	0.000	0.000	0.000
22	A	26	GLY	0	0.048	0.032	23.947	0.005	0.005	0.000	0.000	0.000	0.000
23	A	27	LEU	0	-0.008	0.019	16.472	0.013	0.013	0.000	0.000	0.000	0.000
24	A	28	THR	0	-0.035	-0.027	19.285	0.021	0.021	0.000	0.000	0.000	0.000
25	A	29	PHE	0	0.064	0.012	14.289	-0.007	-0.007	0.000	0.000	0.000	0.000
26	A	30	ARG	1	0.974	0.983	16.511	-0.188	-0.188	0.000	0.000	0.000	0.000
27	A	31	ALA	0	0.048	0.016	18.710	-0.013	-0.013	0.000	0.000	0.000	0.000
28	A	32	VAL	0	0.006	0.006	12.729	-0.016	-0.016	0.000	0.000	0.000	0.000
29	A	33	ASP	-1	-0.812	-0.915	13.458	0.402	0.402	0.000	0.000	0.000	0.000
30	A	34	VAL	0	-0.049	-0.020	15.184	-0.037	-0.037	0.000	0.000	0.000	0.000
31	A	35	GLU	-1	-0.881	-0.930	16.058	0.033	0.033	0.000	0.000	0.000	0.000
32	A	36	ALA	0	-0.022	0.006	11.562	-0.029	-0.029	0.000	0.000	0.000	0.000
33	A	37	ASN	0	0.014	-0.007	10.746	0.021	0.021	0.000	0.000	0.000	0.000
34	A	38	VAL	0	-0.095	-0.047	8.940	-0.046	-0.046	0.000	0.000	0.000	0.000
35	A	39	PRO	0	0.085	0.031	12.116	0.087	0.087	0.000	0.000	0.000	0.000
36	A	40	LYS	1	0.897	0.956	14.176	-0.055	-0.055	0.000	0.000	0.000	0.000
37	A	41	GLY	0	0.030	0.011	14.200	-0.017	-0.017	0.000	0.000	0.000	0.000
38	A	42	THR	0	-0.086	-0.034	8.645	0.018	0.018	0.000	0.000	0.000	0.000
39	A	43	ALA	0	0.044	0.015	10.780	0.192	0.192	0.000	0.000	0.000	0.000
40	A	44	SER	0	-0.008	-0.008	11.626	0.126	0.126	0.000	0.000	0.000	0.000
41	A	45	ASN	0	-0.034	-0.017	10.425	-0.036	-0.036	0.000	0.000	0.000	0.000
42	A	46	TYR	0	-0.042	-0.029	3.291	-1.109	0.352	0.121	-0.619	-0.962	0.001
43	A	47	PHE	0	-0.033	-0.014	8.644	0.335	0.335	0.000	0.000	0.000	0.000
44	A	48	PRO	0	0.010	0.026	11.771	-0.155	-0.155	0.000	0.000	0.000	0.000
45	A	49	SER	0	0.055	0.022	14.764	-0.117	-0.117	0.000	0.000	0.000	0.000
46	A	50	ARG	1	0.914	0.955	15.925	-0.204	-0.204	0.000	0.000	0.000	0.000
47	A	51	ASP	-1	-0.883	-0.973	17.816	0.320	0.320	0.000	0.000	0.000	0.000
48	A	52	ASP	-1	-0.842	-0.917	12.314	0.926	0.926	0.000	0.000	0.000	0.000
49	A	53	LEU	0	-0.042	-0.009	12.505	0.068	0.068	0.000	0.000	0.000	0.000
50	A	54	PHE	0	-0.049	-0.046	13.880	-0.009	-0.009	0.000	0.000	0.000	0.000
51	A	55	ASP	-1	-0.773	-0.874	14.326	0.357	0.357	0.000	0.000	0.000	0.000
52	A	56	GLN	0	-0.045	-0.011	7.712	0.109	0.109	0.000	0.000	0.000	0.000
53	A	57	VAL	0	0.015	-0.005	11.747	-0.081	-0.081	0.000	0.000	0.000	0.000
54	A	58	GLY	0	0.018	0.007	13.653	-0.075	-0.075	0.000	0.000	0.000	0.000
55	A	59	LYS	1	0.846	0.916	12.015	-0.270	-0.270	0.000	0.000	0.000	0.000
56	A	60	ARG	1	0.787	0.853	7.255	0.035	0.035	0.000	0.000	0.000	0.000
57	A	61	ILE	0	-0.004	0.006	12.509	-0.073	-0.073	0.000	0.000	0.000	0.000
58	A	62	HIS	0	0.010	-0.017	15.786	-0.038	-0.038	0.000	0.000	0.000	0.000
59	A	63	GLU	-1	-0.828	-0.857	10.952	-0.158	-0.158	0.000	0.000	0.000	0.000
60	A	64	ARG	1	0.805	0.909	14.775	-0.008	-0.008	0.000	0.000	0.000	0.000
61	A	65	LEU	0	-0.024	0.022	16.842	-0.005	-0.005	0.000	0.000	0.000	0.000
62	A	81	ASN	0	0.038	0.000	37.726	-0.001	-0.001	0.000	0.000	0.000	0.000
63	A	82	LEU	0	0.038	0.016	38.366	0.000	0.000	0.000	0.000	0.000	0.000
64	A	83	GLU	-1	-0.930	-0.974	39.491	-0.027	-0.027	0.000	0.000	0.000	0.000
65	A	84	LEU	0	0.036	0.031	33.382	-0.001	-0.001	0.000	0.000	0.000	0.000
66	A	85	ALA	0	0.003	0.002	34.472	-0.002	-0.002	0.000	0.000	0.000	0.000
67	A	86	ILE	0	-0.010	-0.007	34.807	0.001	0.001	0.000	0.000	0.000	0.000
68	A	87	GLU	-1	-0.891	-0.944	35.777	-0.039	-0.039	0.000	0.000	0.000	0.000
69	A	88	TYR	0	-0.053	-0.021	26.431	-0.006	-0.006	0.000	0.000	0.000	0.000
70	A	89	MET	0	-0.013	-0.008	31.000	-0.001	-0.001	0.000	0.000	0.000	0.000
71	A	90	GLN	0	-0.006	-0.025	32.566	0.000	0.000	0.000	0.000	0.000	0.000
72	A	91	GLY	0	0.024	0.026	31.761	0.000	0.000	0.000	0.000	0.000	0.000
73	A	92	LEU	0	-0.094	-0.055	25.644	-0.004	-0.004	0.000	0.000	0.000	0.000
74	A	93	PHE	0	-0.013	-0.012	28.538	0.002	0.002	0.000	0.000	0.000	0.000
75	A	94	GLY	0	0.068	0.041	31.163	0.003	0.003	0.000	0.000	0.000	0.000
76	A	95	ARG	1	0.856	0.925	22.379	0.074	0.074	0.000	0.000	0.000	0.000
77	A	96	ILE	0	0.014	0.021	26.019	-0.003	-0.003	0.000	0.000	0.000	0.000
78	A	97	THR	0	0.032	-0.001	26.773	0.006	0.006	0.000	0.000	0.000	0.000
79	A	98	ARG	1	0.905	0.967	22.649	0.088	0.088	0.000	0.000	0.000	0.000
80	A	99	ASP	-1	-0.902	-0.955	21.432	-0.066	-0.066	0.000	0.000	0.000	0.000
81	A	100	ARG	1	0.978	0.997	23.166	0.001	0.001	0.000	0.000	0.000	0.000
82	A	101	THR	0	-0.007	-0.015	19.193	0.011	0.011	0.000	0.000	0.000	0.000
83	A	102	GLY	0	0.025	0.006	19.486	0.019	0.019	0.000	0.000	0.000	0.000
84	A	103	TYR	0	0.076	0.013	20.370	0.018	0.018	0.000	0.000	0.000	0.000
85	A	104	LEU	0	0.031	0.019	23.582	0.011	0.011	0.000	0.000	0.000	0.000
86	A	105	ALA	0	0.017	0.015	19.404	0.013	0.013	0.000	0.000	0.000	0.000
87	A	106	LEU	0	-0.020	0.006	20.764	0.023	0.023	0.000	0.000	0.000	0.000
88	A	107	GLN	0	0.005	-0.003	21.896	0.011	0.011	0.000	0.000	0.000	0.000
89	A	108	GLU	-1	-0.811	-0.908	22.895	0.114	0.114	0.000	0.000	0.000	0.000
90	A	109	LEU	0	-0.030	-0.023	17.567	0.014	0.014	0.000	0.000	0.000	0.000
91	A	110	ARG	1	0.941	0.971	22.164	-0.068	-0.068	0.000	0.000	0.000	0.000
92	A	111	LEU	0	0.002	-0.001	25.123	0.002	0.002	0.000	0.000	0.000	0.000
93	A	112	GLU	-1	-0.855	-0.933	22.507	0.185	0.185	0.000	0.000	0.000	0.000
94	A	113	ALA	0	0.008	0.013	23.611	0.009	0.009	0.000	0.000	0.000	0.000
95	A	114	VAL	0	-0.039	-0.017	24.716	0.000	0.000	0.000	0.000	0.000	0.000
96	A	115	ARG	1	0.866	0.932	26.996	-0.140	-0.140	0.000	0.000	0.000	0.000
97	A	116	ARG	1	0.844	0.942	21.457	-0.265	-0.265	0.000	0.000	0.000	0.000
98	A	117	PRO	0	0.013	-0.009	23.694	0.002	0.002	0.000	0.000	0.000	0.000
99	A	118	GLU	-1	-0.893	-0.935	18.717	0.278	0.278	0.000	0.000	0.000	0.000
100	A	119	LEU	0	0.078	0.048	18.316	0.002	0.002	0.000	0.000	0.000	0.000
101	A	120	ARG	1	0.876	0.937	20.374	-0.158	-0.158	0.000	0.000	0.000	0.000
102	A	121	THR	0	-0.019	0.007	21.395	-0.028	-0.028	0.000	0.000	0.000	0.000
103	A	122	THR	0	-0.001	-0.004	15.753	-0.028	-0.028	0.000	0.000	0.000	0.000
104	A	123	LEU	0	-0.009	-0.009	18.887	-0.018	-0.018	0.000	0.000	0.000	0.000
105	A	124	THR	0	-0.059	-0.040	20.387	-0.028	-0.028	0.000	0.000	0.000	0.000
106	A	125	ARG	1	0.945	0.976	19.528	-0.192	-0.192	0.000	0.000	0.000	0.000
107	A	126	THR	0	0.048	0.026	16.944	-0.016	-0.016	0.000	0.000	0.000	0.000
108	A	127	ILE	0	0.002	0.012	19.428	-0.023	-0.023	0.000	0.000	0.000	0.000
109	A	128	SER	0	0.002	0.002	22.677	-0.017	-0.017	0.000	0.000	0.000	0.000
110	A	129	GLU	-1	-1.016	-1.008	19.586	0.081	0.081	0.000	0.000	0.000	0.000
111	A	130	ASN	0	-0.010	-0.008	20.811	-0.019	-0.019	0.000	0.000	0.000	0.000
112	A	131	LEU	0	0.034	0.029	22.667	-0.009	-0.009	0.000	0.000	0.000	0.000
113	A	132	LYS	1	0.908	0.944	25.213	-0.047	-0.047	0.000	0.000	0.000	0.000
114	A	133	ARG	1	0.911	0.954	19.400	-0.021	-0.021	0.000	0.000	0.000	0.000
115	A	134	ASP	-1	-0.844	-0.909	25.755	-0.014	-0.014	0.000	0.000	0.000	0.000
116	A	135	ILE	0	-0.072	-0.038	27.831	-0.002	-0.002	0.000	0.000	0.000	0.000
117	A	136	GLY	0	-0.013	-0.009	29.454	-0.002	-0.002	0.000	0.000	0.000	0.000
118	A	137	PHE	0	0.039	0.018	27.819	-0.004	-0.004	0.000	0.000	0.000	0.000
119	A	138	HIS	0	-0.020	-0.026	29.851	-0.004	-0.004	0.000	0.000	0.000	0.000
120	A	139	LEU	0	-0.057	-0.032	33.047	0.000	0.000	0.000	0.000	0.000	0.000
121	A	140	ASP	-1	-0.921	-0.955	31.382	-0.020	-0.020	0.000	0.000	0.000	0.000
122	A	141	SER	0	-0.115	-0.051	33.132	-0.003	-0.003	0.000	0.000	0.000	0.000
123	A	142	GLY	0	-0.010	-0.003	34.693	-0.002	-0.002	0.000	0.000	0.000	0.000
124	A	143	LEU	0	-0.067	-0.026	34.742	0.001	0.001	0.000	0.000	0.000	0.000
125	A	144	PRO	0	0.014	0.020	38.560	0.002	0.002	0.000	0.000	0.000	0.000
126	A	145	GLY	0	0.059	0.022	39.301	-0.001	-0.001	0.000	0.000	0.000	0.000
127	A	146	ASP	-1	-0.842	-0.924	38.903	0.006	0.006	0.000	0.000	0.000	0.000
128	A	147	ARG	1	0.949	0.946	32.374	-0.024	-0.024	0.000	0.000	0.000	0.000
129	A	148	SER	0	-0.010	-0.011	35.610	0.003	0.003	0.000	0.000	0.000	0.000
130	A	149	THR	0	0.032	0.030	36.629	0.001	0.001	0.000	0.000	0.000	0.000
131	A	150	VAL	0	0.043	0.020	31.076	0.000	0.000	0.000	0.000	0.000	0.000
132	A	151	LEU	0	-0.051	-0.023	32.152	0.002	0.002	0.000	0.000	0.000	0.000
133	A	152	MET	0	0.006	0.017	33.970	0.002	0.002	0.000	0.000	0.000	0.000
134	A	153	LEU	0	0.025	0.014	33.724	0.001	0.001	0.000	0.000	0.000	0.000
135	A	154	TYR	0	-0.013	-0.009	26.469	0.004	0.004	0.000	0.000	0.000	0.000
136	A	155	LEU	0	-0.060	-0.041	30.962	0.003	0.003	0.000	0.000	0.000	0.000
137	A	156	ALA	0	0.012	0.010	33.196	0.002	0.002	0.000	0.000	0.000	0.000
138	A	157	MET	0	0.037	0.023	31.099	0.001	0.001	0.000	0.000	0.000	0.000
139	A	158	ASN	0	-0.035	-0.020	27.816	-0.003	-0.003	0.000	0.000	0.000	0.000
140	A	159	ALA	0	-0.016	-0.014	30.322	0.003	0.003	0.000	0.000	0.000	0.000
141	A	160	LEU	0	0.013	0.022	33.306	0.000	0.000	0.000	0.000	0.000	0.000
142	A	161	ILE	0	0.009	-0.004	27.471	-0.001	-0.001	0.000	0.000	0.000	0.000
143	A	162	VAL	0	-0.002	-0.013	28.964	0.001	0.001	0.000	0.000	0.000	0.000
144	A	163	GLU	-1	-0.869	-0.925	31.033	0.026	0.026	0.000	0.000	0.000	0.000
145	A	164	HIS	0	0.019	0.015	31.841	0.002	0.002	0.000	0.000	0.000	0.000
146	A	165	LEU	0	-0.089	-0.047	27.011	-0.001	-0.001	0.000	0.000	0.000	0.000
147	A	166	THR	0	-0.106	-0.073	30.882	0.003	0.003	0.000	0.000	0.000	0.000
148	A	167	LEU	0	-0.034	-0.009	33.056	0.001	0.001	0.000	0.000	0.000	0.000
149	A	168	PRO	0	0.047	0.029	34.821	-0.002	-0.002	0.000	0.000	0.000	0.000
150	A	169	GLY	0	-0.006	-0.008	37.182	-0.002	-0.002	0.000	0.000	0.000	0.000
151	A	170	VAL	0	-0.040	-0.008	39.499	-0.001	-0.001	0.000	0.000	0.000	0.000
152	A	171	LEU	0	-0.030	-0.032	36.929	-0.001	-0.001	0.000	0.000	0.000	0.000
153	A	172	GLU	-1	-0.927	-0.940	40.933	0.000	0.000	0.000	0.000	0.000	0.000
154	A	173	GLY	0	-0.035	-0.012	42.587	-0.002	-0.002	0.000	0.000	0.000	0.000
155	A	174	VAL	0	-0.079	-0.049	41.751	0.000	0.000	0.000	0.000	0.000	0.000
156	A	175	ASP	-1	-0.859	-0.924	42.383	-0.012	-0.012	0.000	0.000	0.000	0.000
157	A	176	THR	0	-0.001	-0.026	37.764	-0.001	-0.001	0.000	0.000	0.000	0.000
158	A	177	GLU	-1	-0.890	-0.934	38.826	-0.023	-0.023	0.000	0.000	0.000	0.000
159	A	178	ARG	1	0.995	1.006	40.013	0.004	0.004	0.000	0.000	0.000	0.000
160	A	179	LEU	0	-0.051	-0.009	39.505	0.001	0.001	0.000	0.000	0.000	0.000
161	A	180	VAL	0	0.021	-0.002	35.685	0.002	0.002	0.000	0.000	0.000	0.000
162	A	181	ALA	0	0.042	0.026	38.634	0.000	0.000	0.000	0.000	0.000	0.000
163	A	182	ASP	-1	-0.910	-0.946	41.025	-0.005	-0.005	0.000	0.000	0.000	0.000
164	A	183	LEU	0	-0.069	-0.039	36.166	0.001	0.001	0.000	0.000	0.000	0.000
165	A	184	VAL	0	0.013	0.000	36.402	0.001	0.001	0.000	0.000	0.000	0.000
166	A	185	THR	0	-0.029	-0.036	39.125	0.000	0.000	0.000	0.000	0.000	0.000
167	A	186	ARG	1	0.893	0.941	42.742	0.001	0.001	0.000	0.000	0.000	0.000
168	A	187	ALA	0	-0.013	0.003	38.691	0.001	0.001	0.000	0.000	0.000	0.000
169	A	188	VAL	0	-0.006	0.008	38.900	0.001	0.001	0.000	0.000	0.000	0.000
170	A	189	ALA	0	-0.033	0.002	41.161	0.000	0.000	0.000	0.000	0.000	0.000
171	A	190	THR	0	-0.001	-0.004	42.977	0.001	0.001	0.000	0.000	0.000	0.000
172	A	191	PRO	0	-0.046	-0.018	45.503	0.000	0.000	0.000	0.000	0.000	0.000
173	A	192	ASP	-1	-0.906	-0.943	47.667	0.007	0.007	0.000	0.000	0.000	0.000
174	A	193	ALA	0	-0.063	-0.035	47.237	0.001	0.001	0.000	0.000	0.000	0.000

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Interactive mode: IFIE and PIEDA for fragment #1(A:5:PRO)