## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
B |
182 |
43 |
11813 |
◊ |
A |
x,y,z |
1_555 |
185 |
50 |
17932 |
1713.6 |
-8.1 |
0.506 |
33 |
20 |
0 |
0.285 |
2 |
|
B |
159 |
40 |
11813 |
x |
B |
-y+1,x-y+1,z |
2_665 |
140 |
38 |
11813 |
1479.2 |
-15.0 |
0.148 |
14 |
3 |
0 |
0.561 |
3 |
|
A |
142 |
35 |
17932 |
x |
A |
-y+1,x-y+1,z |
2_665 |
143 |
39 |
17932 |
1378.5 |
-10.7 |
0.280 |
23 |
7 |
0 |
0.288 |
4 |
|
A |
62 |
21 |
17932 |
◊ |
A |
x-y+1/3,-y+2/3,-z+2/3 |
17_555 |
62 |
21 |
17932 |
588.1 |
-10.0 |
0.052 |
0 |
0 |
0 |
0.000 |
5 |
|
A |
26 |
11 |
17932 |
◊ |
A |
y,x,-z+1 |
4_556 |
25 |
11 |
17932 |
239.8 |
-2.0 |
0.412 |
2 |
0 |
0 |
0.000 |
6 |
|
[PEY]A:701 |
14 |
1 |
334 |
f |
A |
x,y,z |
1_555 |
39 |
17 |
17932 |
230.1 |
1.4 |
0.183 |
0 |
0 |
0 |
0.000 |
7 |
|
B |
22 |
8 |
11813 |
◊ |
B |
x-y+2/3,-y+4/3,-z+1/3 |
11_565 |
22 |
8 |
11813 |
191.4 |
-1.4 |
0.474 |
5 |
0 |
0 |
0.004 |
8 |
|
B |
21 |
7 |
11813 |
◊ |
B |
-x+2/3,-x+y+1/3,-z+1/3 |
12_555 |
21 |
7 |
11813 |
181.7 |
0.1 |
0.670 |
2 |
0 |
0 |
0.000 |
9 |
|
A |
15 |
7 |
17932 |
◊ |
B |
-y+1,x-y+1,z |
2_665 |
24 |
6 |
11813 |
158.3 |
-1.0 |
0.446 |
1 |
0 |
0 |
0.011 |
10 |
|
[EDO]B:705 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
26 |
8 |
11813 |
123.2 |
3.8 |
0.650 |
4 |
0 |
0 |
0.000 |
11 |
|
[FES]A:714 |
4 |
1 |
235 |
f |
A |
x,y,z |
1_555 |
17 |
8 |
17932 |
122.3 |
-16.1 |
0.639 |
2 |
0 |
0 |
0.223 |
12 |
|
[EDO]B:707 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
18 |
8 |
11813 |
115.0 |
4.0 |
0.498 |
4 |
0 |
0 |
0.000 |
13 |
|
[SO4]B:710 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
17 |
8 |
11813 |
114.9 |
-16.1 |
0.802 |
4 |
0 |
0 |
0.462 |
14 |
|
[EDO]A:722 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
21 |
8 |
17932 |
108.3 |
3.0 |
0.484 |
2 |
0 |
0 |
0.000 |
15 |
|
[EDO]A:721 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
17932 |
101.9 |
2.8 |
0.433 |
2 |
0 |
0 |
0.000 |
16 |
|
[EDO]A:716 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
18 |
9 |
17932 |
100.9 |
2.9 |
0.445 |
3 |
0 |
0 |
0.000 |
17 |
|
[EDO]B:712 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
17 |
7 |
11813 |
93.1 |
2.2 |
0.284 |
3 |
0 |
0 |
0.000 |
18 |
|
[EDO]A:702 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
21 |
8 |
17932 |
90.5 |
2.8 |
0.670 |
5 |
0 |
0 |
0.000 |
19 |
|
[SO4]A:704 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
17932 |
88.5 |
-13.3 |
0.815 |
4 |
0 |
0 |
0.197 |
20 |
|
[EDO]A:717 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
11 |
5 |
17932 |
84.6 |
2.6 |
0.399 |
0 |
0 |
0 |
0.000 |
21 |
|
[EDO]A:720 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
14 |
4 |
17932 |
83.6 |
2.1 |
0.279 |
1 |
0 |
0 |
0.000 |
22 |
|
[SO4]A:713 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
17932 |
83.1 |
-11.1 |
0.839 |
0 |
0 |
0 |
0.145 |
23 |
|
[EDO]B:718 |
4 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
14 |
4 |
11813 |
81.2 |
2.2 |
0.280 |
1 |
0 |
0 |
0.000 |
24 |
|
[EDO]B:708 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
10 |
4 |
11813 |
79.4 |
2.0 |
0.206 |
2 |
0 |
0 |
0.000 |
25 |
|
B |
12 |
3 |
11813 |
◊ |
A |
x-y+1/3,-y+2/3,-z+2/3 |
17_555 |
8 |
3 |
17932 |
78.4 |
-1.1 |
0.294 |
1 |
0 |
0 |
0.000 |
26 |
|
[EDO]A:723 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
17932 |
77.3 |
1.9 |
0.823 |
2 |
0 |
0 |
0.000 |
27 |
|
[EDO]A:703 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
17932 |
74.6 |
2.0 |
0.241 |
1 |
0 |
0 |
0.000 |
28 |
|
A |
12 |
6 |
17932 |
◊ |
[EDO]A:703 |
-y+1,x-y+1,z |
2_665 |
4 |
1 |
184 |
72.2 |
1.7 |
0.247 |
0 |
0 |
0 |
0.000 |
29 |
|
[EDO]B:719 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
10 |
5 |
11813 |
70.3 |
2.0 |
0.271 |
0 |
0 |
0 |
0.000 |
30 |
|
[EDO]A:711 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
10 |
3 |
17932 |
69.5 |
1.3 |
0.204 |
1 |
0 |
0 |
0.000 |
31 |
|
[EDO]B:718 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
17932 |
68.5 |
1.7 |
0.227 |
1 |
0 |
0 |
0.000 |
32 |
|
A |
9 |
5 |
17932 |
f |
[SO4]B:714 |
-y+1,x-y+1,z |
2_665 |
5 |
1 |
185 |
60.8 |
-8.4 |
0.623 |
0 |
0 |
0 |
0.109 |
33 |
|
B |
5 |
2 |
11813 |
◊ |
A |
y-2/3,x-1/3,-z+2/3 |
16_445 |
6 |
2 |
17932 |
58.8 |
0.4 |
0.738 |
0 |
2 |
0 |
0.000 |
34 |
|
[FE]A:450 |
1 |
1 |
137 |
f |
A |
x,y,z |
1_555 |
8 |
6 |
17932 |
56.4 |
-10.6 |
0.000 |
0 |
0 |
0 |
0.139 |
35 |
|
[EDO]A:717 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
11813 |
55.7 |
1.4 |
0.889 |
2 |
0 |
0 |
0.000 |
36 |
|
[EDO]B:706 |
2 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
12 |
4 |
17932 |
55.2 |
1.7 |
0.606 |
0 |
0 |
0 |
0.000 |
37 |
|
[EDO]A:715 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
10 |
2 |
17932 |
54.4 |
0.9 |
0.747 |
1 |
0 |
0 |
0.000 |
38 |
|
[SO4]B:709 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
7 |
5 |
11813 |
53.7 |
-6.2 |
0.904 |
2 |
0 |
0 |
0.184 |
39 |
|
[EDO]B:708 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
17932 |
53.0 |
1.2 |
0.674 |
1 |
0 |
0 |
0.000 |
40 |
|
[SO4]B:714 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
6 |
1 |
11813 |
50.7 |
-6.3 |
0.839 |
1 |
0 |
0 |
0.049 |
41 |
|
[EDO]B:706 |
3 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
5 |
3 |
11813 |
50.7 |
1.4 |
0.905 |
1 |
0 |
0 |
0.000 |
42 |
|
[EDO]A:702 |
4 |
1 |
185 |
f |
A |
-y+1,x-y+1,z |
2_665 |
8 |
2 |
17932 |
49.4 |
0.5 |
0.604 |
1 |
0 |
0 |
0.000 |
43 |
|
B |
4 |
2 |
11813 |
◊ |
A |
-x+4/3,-x+y+2/3,-z+2/3 |
18_655 |
6 |
2 |
17932 |
43.0 |
0.6 |
0.763 |
1 |
1 |
0 |
0.000 |
44 |
|
[SO4]B:714 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
17932 |
40.0 |
-5.0 |
0.425 |
0 |
0 |
0 |
0.066 |
45 |
|
[EDO]A:716 |
3 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
5 |
2 |
11813 |
39.6 |
1.5 |
0.956 |
2 |
0 |
0 |
0.000 |
46 |
|
[EDO]A:711 |
3 |
1 |
184 |
◊ |
A |
-y+1,x-y+1,z |
2_665 |
4 |
1 |
17932 |
37.5 |
1.1 |
0.775 |
0 |
0 |
0 |
0.000 |
47 |
|
[EDO]B:719 |
2 |
1 |
184 |
f |
B |
-y+1,x-y+1,z |
2_665 |
3 |
1 |
11813 |
35.6 |
1.2 |
0.923 |
1 |
0 |
0 |
0.000 |
48 |
|
[PEY]A:701 |
7 |
1 |
334 |
f |
[FE]A:450 |
x,y,z |
1_555 |
1 |
1 |
137 |
33.1 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.048 |
49 |
|
A |
2 |
1 |
17932 |
f |
[EDO]A:720 |
-y+1,x-y+1,z |
2_665 |
1 |
1 |
183 |
25.3 |
0.9 |
0.978 |
1 |
0 |
0 |
0.000 |
50 |
|
[EDO]B:712 |
2 |
1 |
186 |
f |
[EDO]A:717 |
x,y,z |
1_555 |
2 |
1 |
183 |
18.6 |
0.7 |
1.000 |
0 |
0 |
0 |
0.000 |
51 |
|
[EDO]B:707 |
3 |
1 |
185 |
f |
B |
-y+1,x-y+1,z |
2_665 |
1 |
1 |
11813 |
17.0 |
0.6 |
0.956 |
0 |
0 |
0 |
0.000 |
52 |
|
[EDO]B:712 |
2 |
1 |
186 |
f |
[SO4]B:709 |
x,y,z |
1_555 |
1 |
1 |
183 |
13.1 |
-1.3 |
0.894 |
0 |
0 |
0 |
0.032 |
53 |
|
[FES]A:714 |
3 |
1 |
235 |
◊ |
A |
-y+1,x-y+1,z |
2_665 |
3 |
2 |
17932 |
5.5 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.007 |
54 |
|
A |
1 |
1 |
17932 |
f |
[EDO]A:715 |
-y+1,x-y+1,z |
2_665 |
1 |
1 |
184 |
5.3 |
0.2 |
0.892 |
0 |
0 |
0 |
0.000 |
55 |
|
[EDO]B:705 |
1 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
17932 |
3.1 |
-0.0 |
0.613 |
0 |
0 |
0 |
0.000 |
56 |
|
A |
1 |
1 |
17932 |
◊ |
[FE]A:450 |
-y+1,x-y+1,z |
2_665 |
1 |
1 |
137 |
1.6 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.002 |
57 |
|
[SO4]A:713 |
1 |
1 |
185 |
◊ |
A |
y,x,-z+1 |
4_556 |
1 |
1 |
17932 |
0.2 |
-0.0 |
0.807 |
0 |
0 |
0 |
0.000 |
|