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Crystal structure of methionyl-tRNA synthetase MetRS from Brucella melitensis in complex with inhibitor Chem 1312Brucella suis 1330

Structure Details

MethodX-ray

Resolution2.45 Å

Molecular Weight182.14 kDa

Chain Count3

Classificationligase/ligase inhibitor

Deposition DateMay 17, 2016

Rank	Score	Volume (\u00c5\u00b3)	Center X	Center Y	Center Z
1	0.93	4138.5	1.4	7.1	61.6
2	0.91	2874.9	-4.2	31.7	67.8
3	0.90	2844.0	12.1	-22.8	32.2
4	0.88	2544.4	30.6	12.3	22.0
5	0.84	2412.4	26.4	-31.9	49.5
6	0.82	2894.4	16.7	-19.5	65.0
7	0.82	4696.4	16.5	-4.5	18.4
8	0.74	2430.9	16.7	-30.3	46.8
9	0.68	4221.9	29.9	-30.1	62.9
10	0.67	1898.6	-10.6	18.6	65.8
11	0.63	1931.8	28.5	2.1	9.4
12	0.61	1302.0	-3.9	15.0	70.5
13	0.56	1057.8	27.1	11.0	11.6
14	0.55	1319.9	17.2	-31.8	36.8
15	0.54	1247.0	12.1	-12.2	56.4
16	0.53	1385.4	24.7	33.1	45.1
17	0.51	1552.3	24.0	-15.8	57.0
18	0.48	1508.5	38.8	6.5	-5.1
19	0.45	1260.5	25.5	-19.8	22.9
20	0.44	2288.8	-0.5	-8.6	18.6
21	0.44	1502.3	13.5	44.1	59.0
22	0.42	3679.8	-9.7	9.0	54.8
23	0.40	532.3	34.9	-22.2	53.1
24	0.38	845.1	35.5	16.9	7.9
25	0.36	1636.4	-12.9	28.5	62.0
26	0.35	907.4	5.2	21.9	69.3
27	0.35	1462.1	33.6	19.1	44.6
28	0.34	1779.4	24.6	-36.8	76.6
29	0.32	1595.4	20.9	29.5	16.6
30	0.31	1169.8	17.6	-36.8	16.0
31	0.28	2887.1	4.3	-12.5	77.5
32	0.26	3129.6	8.8	7.5	85.1
33	0.25	1385.0	10.1	36.4	44.4
34	0.25	1013.5	-4.7	-29.8	-2.3
35	0.24	2214.8	-23.4	14.2	66.5
36	0.23	1701.8	5.3	39.3	53.2
37	0.23	570.0	29.0	10.7	32.7
38	0.21	1072.1	38.1	20.1	30.2
39	0.21	536.1	0.1	-17.9	6.8
40	0.21	1613.6	13.5	-24.4	82.5
41	0.20	2399.1	-1.0	-30.6	12.4
42	0.20	1324.5	-1.1	-30.6	28.7
43	0.19	2362.5	9.4	29.6	52.6
44	0.19	2429.0	14.1	24.9	35.5
45	0.16	1520.3	20.2	0.2	56.2
46	0.15	1922.5	-2.9	-10.0	5.0
47	0.12	2139.6	2.3	-18.8	41.4
48	0.10	1955.3	18.5	26.0	-1.5
49	0.10	2236.5	57.6	3.6	-4.8
50	0.08	2217.1	28.5	-47.4	27.0
51	0.07	2298.5	13.4	-7.9	-2.0