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Crystal structure of isocitrate lyase and phosphorylmutase:isocitrate lyase from Brucella melitensis biovar Abortus 2308 bound to itaconic acidBrucella abortus 2308

Structure Details

MethodX-ray

Resolution1.8 Å

Molecular Weight197.74 kDa

Chain Count4

ClassificationLYASE/LYASE INHIBITOR

Deposition DateJul 6, 2021

Download CIF View on RCSB PDB

Rank	Score	Volume (\u00c5\u00b3)	Center X	Center Y	Center Z
1	1.00	41370.4	-21.8	8.6	-34.4
2	0.99	6230.8	-21.1	8.1	-33.8
3	0.90	2309.6	-4.6	-19.0	-25.6
4	0.87	2566.1	-37.3	37.5	-42.8
5	0.71	1233.1	-6.1	16.6	-38.0
6	0.71	754.9	-11.4	-9.7	-46.8
7	0.71	747.0	-14.6	-0.9	-12.2
8	0.70	741.0	-34.3	15.6	-54.1
9	0.70	733.5	-26.0	30.8	-22.8
10	0.62	1633.5	-35.9	-6.1	-1.1
11	0.61	1696.5	6.3	1.2	-58.8
12	0.59	3464.0	-36.4	-11.5	-22.9
13	0.59	1562.8	-3.7	40.5	-20.5
14	0.58	1606.3	-53.2	0.3	-54.4
15	0.49	2496.4	6.8	6.3	-39.5
16	0.48	1995.0	-24.6	-5.9	-75.7
17	0.48	733.0	-21.6	42.1	-18.5
18	0.48	1931.5	-18.4	24.2	7.5
19	0.46	2441.5	-7.8	31.3	-41.4
20	0.46	732.6	-17.7	-6.9	-1.5
21	0.46	1865.9	-24.7	-21.5	-43.1
22	0.44	701.3	-26.7	-6.5	-11.1
23	0.44	710.9	-45.1	9.4	-49.2
24	0.44	714.3	-0.3	-2.3	-48.3
25	0.43	708.8	-14.1	35.0	-27.1
26	0.43	1826.0	2.6	4.3	-13.8
27	0.40	1750.9	-34.5	34.8	-62.0
28	0.40	2164.4	-28.9	14.6	-68.6
29	0.38	1770.6	-21.3	26.1	-60.5
30	0.37	1877.5	-11.4	-29.5	-40.4
31	0.36	3074.3	-14.4	-18.2	-59.1
32	0.36	2888.8	-7.3	5.8	-0.3
33	0.35	1917.0	3.1	-11.1	-8.9
34	0.33	1052.9	-17.4	43.5	-37.0
35	0.31	1812.1	-42.9	25.4	-18.4
36	0.30	1461.9	-43.0	41.3	-24.6
37	0.29	2585.5	-41.3	16.2	-70.6
38	0.29	536.6	-11.4	-16.0	-54.4
39	0.29	1541.8	-53.8	19.7	-45.5
40	0.28	504.4	-45.7	13.9	-62.5
41	0.28	559.1	-27.4	36.0	-14.5
42	0.28	1879.5	11.7	6.2	-49.3
43	0.28	532.9	-11.7	0.3	-2.8
44	0.27	1503.5	-10.0	-9.3	-67.4
45	0.26	537.8	-35.8	15.2	-63.9
46	0.26	1648.1	-38.3	2.1	-69.4
47	0.25	1514.5	-15.3	38.3	-44.0
48	0.25	1276.0	9.1	-7.7	-40.1
49	0.24	2131.0	-15.5	36.1	-5.0
50	0.24	1937.8	-47.9	7.7	-34.9
51	0.22	1429.0	-51.3	19.0	-36.3
52	0.21	1720.6	-30.7	30.7	-7.3
53	0.20	1634.1	-28.1	-20.4	-22.7
54	0.20	1168.1	-24.5	-19.5	-13.8
55	0.20	1350.4	5.2	-3.5	-18.6
56	0.18	1268.6	-24.0	33.6	-55.8
57	0.17	1413.6	8.1	-1.8	-33.3
58	0.17	1313.0	-20.7	-24.0	-35.2
59	0.16	1483.1	-46.3	29.2	-26.5
60	0.12	3382.0	9.8	9.3	-18.4
61	0.10	1609.3	-36.4	47.5	-33.8
62	0.07	2084.5	0.8	-26.0	-36.0