## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
1 |
|
D |
204 |
69 |
32820 |
◊ |
C |
x,y,z |
1_555 |
213 |
70 |
32484 |
1964.4 |
-3.3 |
0.763 |
24 |
8 |
0 |
0.000 |
2 |
|
B |
207 |
68 |
32641 |
◊ |
A |
x,y,z |
1_555 |
192 |
62 |
32160 |
1902.0 |
-2.7 |
0.796 |
22 |
7 |
0 |
0.000 |
3 |
|
F |
193 |
63 |
32535 |
◊ |
E |
x,y,z |
1_555 |
198 |
68 |
32694 |
1824.5 |
-2.3 |
0.801 |
22 |
6 |
0 |
0.000 |
Average: |
1897.0 |
-2.8 |
0.787 |
23 |
7 |
0 |
0.000 |
2 |
4 |
|
F |
63 |
20 |
32535 |
◊ |
A |
x,y,z |
1_555 |
75 |
23 |
32160 |
680.2 |
-6.8 |
0.239 |
7 |
4 |
0 |
0.000 |
3 |
5 |
|
F |
75 |
23 |
32535 |
◊ |
D |
x,y,z |
1_555 |
68 |
20 |
32820 |
644.4 |
1.8 |
0.852 |
11 |
1 |
0 |
0.000 |
6 |
|
E |
62 |
18 |
32694 |
◊ |
C |
x,y,z |
1_555 |
61 |
21 |
32484 |
626.4 |
4.8 |
0.931 |
15 |
1 |
0 |
0.000 |
7 |
|
B |
62 |
17 |
32641 |
◊ |
A |
y,x,-z |
4_555 |
67 |
23 |
32160 |
597.1 |
3.5 |
0.804 |
14 |
0 |
0 |
0.000 |
Average: |
622.7 |
3.4 |
0.862 |
13 |
1 |
0 |
0.000 |
4 |
8 |
|
D |
63 |
23 |
32820 |
◊ |
E |
x,y,z-1 |
1_554 |
67 |
25 |
32694 |
570.9 |
5.3 |
0.938 |
8 |
3 |
0 |
0.000 |
9 |
|
B |
61 |
24 |
32641 |
◊ |
B |
y,x,-z+1 |
4_556 |
60 |
24 |
32641 |
494.8 |
4.7 |
0.946 |
8 |
2 |
0 |
0.000 |
Average: |
532.8 |
5.0 |
0.942 |
8 |
3 |
0 |
0.000 |
5 |
10 |
|
B |
72 |
20 |
32641 |
◊ |
B |
y,x,-z |
4_555 |
73 |
20 |
32641 |
544.5 |
-1.9 |
0.624 |
11 |
0 |
0 |
0.000 |
11 |
|
E |
71 |
23 |
32694 |
◊ |
D |
x,y,z |
1_555 |
71 |
23 |
32820 |
529.4 |
0.0 |
0.743 |
13 |
0 |
0 |
0.000 |
Average: |
536.9 |
-0.9 |
0.683 |
12 |
0 |
0 |
0.000 |
6 |
12 |
|
C |
37 |
11 |
32484 |
◊ |
C |
x-y,-y,-z |
5_555 |
37 |
11 |
32484 |
397.4 |
-6.5 |
0.067 |
0 |
0 |
0 |
0.000 |
7 |
13 |
|
C |
36 |
11 |
32484 |
◊ |
A |
x,y,z |
1_555 |
35 |
13 |
32160 |
297.7 |
-0.6 |
0.510 |
1 |
1 |
0 |
0.000 |
8 |
14 |
|
A |
28 |
13 |
32160 |
◊ |
A |
y,x,-z |
4_555 |
30 |
13 |
32160 |
291.3 |
-0.6 |
0.624 |
2 |
0 |
0 |
0.000 |
9 |
15 |
|
[2PE]D:1788 |
19 |
1 |
550 |
f |
D |
x,y,z |
1_555 |
40 |
14 |
32820 |
278.0 |
2.0 |
0.493 |
4 |
0 |
0 |
0.000 |
10 |
16 |
|
B |
27 |
11 |
32641 |
◊ |
A |
x-y,-y,-z |
5_555 |
29 |
7 |
32160 |
255.5 |
-1.5 |
0.415 |
7 |
0 |
0 |
0.000 |
17 |
|
D |
27 |
12 |
32820 |
◊ |
F |
-y+1,x-y,z |
2_655 |
29 |
8 |
32535 |
251.2 |
-0.3 |
0.633 |
8 |
0 |
0 |
0.000 |
18 |
|
C |
29 |
8 |
32484 |
◊ |
E |
-y+1,x-y,z |
2_655 |
29 |
12 |
32694 |
247.5 |
0.9 |
0.747 |
9 |
0 |
0 |
0.000 |
Average: |
251.4 |
-0.3 |
0.598 |
8 |
0 |
0 |
0.000 |
11 |
19 |
|
C |
30 |
8 |
32484 |
◊ |
C |
x-y,-y,-z+1 |
5_556 |
30 |
8 |
32484 |
239.0 |
-0.8 |
0.572 |
2 |
0 |
0 |
0.000 |
12 |
20 |
|
F |
24 |
12 |
32535 |
◊ |
C |
x,y,z |
1_555 |
24 |
13 |
32484 |
232.7 |
-0.5 |
0.609 |
2 |
0 |
0 |
0.000 |
13 |
21 |
|
[PG4]B:1785 |
13 |
1 |
404 |
f |
B |
x,y,z |
1_555 |
36 |
12 |
32641 |
228.4 |
7.9 |
0.569 |
0 |
0 |
0 |
0.000 |
14 |
22 |
|
A |
19 |
7 |
32160 |
◊ |
F |
x,y,z-1 |
1_554 |
19 |
7 |
32535 |
198.1 |
-1.9 |
0.328 |
0 |
0 |
0 |
0.000 |
15 |
23 |
|
[PGE]A:1785 |
10 |
1 |
325 |
f |
A |
x,y,z |
1_555 |
26 |
10 |
32160 |
176.4 |
6.7 |
0.452 |
1 |
0 |
0 |
0.000 |
16 |
24 |
|
C |
25 |
6 |
32484 |
◊ |
E |
x,y,z-1 |
1_554 |
19 |
8 |
32694 |
170.0 |
-3.1 |
0.201 |
0 |
0 |
0 |
0.000 |
25 |
|
D |
17 |
6 |
32820 |
◊ |
F |
x,y,z-1 |
1_554 |
22 |
6 |
32535 |
141.8 |
-2.4 |
0.260 |
0 |
0 |
0 |
0.000 |
26 |
|
B |
19 |
8 |
32641 |
◊ |
A |
y,x,-z+1 |
4_556 |
21 |
6 |
32160 |
141.5 |
-2.5 |
0.255 |
0 |
0 |
0 |
0.000 |
Average: |
151.1 |
-2.7 |
0.239 |
0 |
0 |
0 |
0.000 |
17 |
27 |
|
[PGE]F:1784 |
10 |
1 |
332 |
◊ |
F |
x,y,z |
1_555 |
24 |
6 |
32535 |
163.5 |
4.9 |
0.304 |
1 |
0 |
0 |
0.000 |
18 |
28 |
|
[PEG]C:1787 |
7 |
1 |
264 |
◊ |
C |
x,y,z |
1_555 |
25 |
7 |
32484 |
160.0 |
3.6 |
0.435 |
1 |
0 |
0 |
0.000 |
19 |
29 |
|
[PGE]B:1786 |
10 |
1 |
330 |
f |
B |
x,y,z |
1_555 |
25 |
6 |
32641 |
160.0 |
5.8 |
0.413 |
0 |
0 |
0 |
0.000 |
20 |
30 |
|
[MES]D:1790 |
10 |
1 |
335 |
f |
D |
x,y,z |
1_555 |
21 |
8 |
32820 |
151.0 |
3.0 |
0.200 |
0 |
0 |
0 |
0.000 |
21 |
31 |
|
[PGE]A:1786 |
10 |
1 |
343 |
f |
F |
x,y,z-1 |
1_554 |
21 |
9 |
32535 |
149.2 |
2.2 |
0.128 |
2 |
0 |
0 |
0.000 |
22 |
32 |
|
[MES]E:1787 |
10 |
1 |
334 |
f |
E |
x,y,z |
1_555 |
19 |
7 |
32694 |
143.5 |
2.5 |
0.142 |
0 |
0 |
0 |
0.000 |
23 |
33 |
|
[MES]B:1789 |
9 |
1 |
338 |
f |
B |
x,y,z |
1_555 |
20 |
7 |
32641 |
140.3 |
2.3 |
0.177 |
0 |
0 |
0 |
0.000 |
24 |
34 |
|
[PEG]C:1785 |
7 |
1 |
255 |
f |
C |
x,y,z |
1_555 |
24 |
7 |
32484 |
131.8 |
3.1 |
0.324 |
3 |
0 |
0 |
0.000 |
25 |
35 |
|
[PEG]A:1788 |
7 |
1 |
257 |
f |
A |
x,y,z |
1_555 |
24 |
6 |
32160 |
128.0 |
2.8 |
0.368 |
2 |
0 |
0 |
0.000 |
26 |
36 |
|
[PEG]E:1784 |
7 |
1 |
264 |
f |
E |
x,y,z |
1_555 |
18 |
5 |
32694 |
126.7 |
2.3 |
0.265 |
0 |
0 |
0 |
0.000 |
27 |
37 |
|
[PGE]E:1785 |
7 |
1 |
260 |
f |
E |
x,y,z |
1_555 |
21 |
8 |
32694 |
122.7 |
3.7 |
0.125 |
0 |
0 |
0 |
0.000 |
28 |
38 |
|
[PEG]D:1785 |
7 |
1 |
259 |
f |
D |
x,y,z |
1_555 |
19 |
5 |
32820 |
120.6 |
2.8 |
0.328 |
1 |
0 |
0 |
0.000 |
29 |
39 |
|
[EDO]C:1786 |
4 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
18 |
7 |
32484 |
113.5 |
3.0 |
0.383 |
3 |
0 |
0 |
0.000 |
30 |
40 |
|
[PGE]A:1786 |
9 |
1 |
343 |
◊ |
A |
x,y,z |
1_555 |
14 |
5 |
32160 |
112.5 |
3.4 |
0.225 |
1 |
0 |
0 |
0.000 |
31 |
41 |
|
[OAA]E:1786 |
9 |
1 |
264 |
f |
E |
x,y,z |
1_555 |
14 |
6 |
32694 |
111.7 |
0.4 |
0.490 |
1 |
0 |
0 |
0.000 |
32 |
42 |
|
[PEG]D:1784 |
4 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
19 |
6 |
32820 |
110.6 |
2.9 |
0.417 |
0 |
0 |
0 |
0.000 |
33 |
43 |
|
[PEG]F:1785 |
7 |
1 |
264 |
f |
F |
x,y,z |
1_555 |
18 |
7 |
32535 |
106.7 |
2.0 |
0.269 |
1 |
0 |
0 |
0.000 |
34 |
44 |
|
[OAA]C:1789 |
9 |
1 |
260 |
f |
C |
x,y,z |
1_555 |
15 |
5 |
32484 |
106.6 |
-0.2 |
0.370 |
1 |
0 |
0 |
0.000 |
35 |
45 |
|
[OAA]C:1788 |
9 |
1 |
261 |
f |
C |
x,y,z |
1_555 |
18 |
7 |
32484 |
105.7 |
-0.0 |
0.474 |
1 |
0 |
0 |
0.000 |
36 |
46 |
|
B |
11 |
4 |
32641 |
◊ |
B |
x-y,-y,-z |
5_555 |
11 |
4 |
32641 |
99.2 |
-1.3 |
0.328 |
0 |
0 |
0 |
0.000 |
47 |
|
D |
10 |
6 |
32820 |
◊ |
E |
-y+1,x-y,z |
2_655 |
10 |
6 |
32694 |
74.3 |
-0.9 |
0.393 |
0 |
0 |
0 |
0.000 |
Average: |
86.8 |
-1.1 |
0.360 |
0 |
0 |
0 |
0.000 |
37 |
48 |
|
[PEG]D:1786 |
4 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
21 |
7 |
32820 |
97.7 |
2.9 |
0.515 |
1 |
0 |
0 |
0.000 |
38 |
49 |
|
[EDO]B:1788 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
19 |
6 |
32641 |
96.4 |
3.2 |
0.506 |
1 |
0 |
0 |
0.000 |
39 |
50 |
|
[MES]D:1790 |
8 |
1 |
335 |
◊ |
C |
x,y,z |
1_555 |
13 |
5 |
32484 |
93.7 |
4.2 |
0.407 |
0 |
0 |
0 |
0.000 |
40 |
51 |
|
[PEG]B:1784 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
11 |
6 |
32641 |
90.8 |
2.2 |
0.229 |
1 |
0 |
0 |
0.000 |
41 |
52 |
|
[EDO]D:1787 |
4 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
11 |
6 |
32820 |
90.6 |
2.2 |
0.410 |
1 |
0 |
0 |
0.000 |
42 |
53 |
|
[MES]B:1789 |
6 |
1 |
338 |
◊ |
A |
x,y,z |
1_555 |
12 |
5 |
32160 |
90.1 |
4.0 |
0.560 |
0 |
0 |
0 |
0.000 |
43 |
54 |
|
[MES]E:1787 |
8 |
1 |
334 |
◊ |
F |
x,y,z |
1_555 |
11 |
5 |
32535 |
87.5 |
3.6 |
0.341 |
0 |
0 |
0 |
0.000 |
44 |
55 |
|
[EDO]A:1787 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
32160 |
83.0 |
1.9 |
0.255 |
1 |
0 |
0 |
0.000 |
45 |
56 |
|
[PEG]C:1784 |
4 |
1 |
185 |
◊ |
E |
-y+1,x-y,z |
2_655 |
12 |
5 |
32694 |
80.5 |
2.4 |
0.262 |
0 |
0 |
0 |
0.000 |
46 |
57 |
|
[EDO]B:1787 |
4 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
16 |
4 |
32641 |
78.4 |
2.0 |
0.371 |
0 |
0 |
0 |
0.000 |
47 |
58 |
|
[PEG]D:1789 |
4 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
12 |
4 |
32820 |
71.3 |
1.2 |
0.718 |
1 |
0 |
0 |
0.000 |
48 |
59 |
|
[PEG]C:1784 |
4 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
11 |
4 |
32484 |
47.2 |
1.0 |
0.731 |
0 |
0 |
0 |
0.000 |
49 |
60 |
|
[PEG]D:1789 |
4 |
1 |
185 |
f |
F |
-y+1,x-y,z |
2_655 |
10 |
4 |
32535 |
43.4 |
0.6 |
0.738 |
0 |
0 |
0 |
0.000 |
50 |
61 |
|
[OAA]C:1789 |
4 |
1 |
260 |
f |
[OAA]C:1788 |
x,y,z |
1_555 |
4 |
1 |
261 |
35.6 |
0.5 |
0.437 |
0 |
0 |
0 |
0.000 |
51 |
62 |
|
[PEG]C:1787 |
4 |
1 |
264 |
f |
C |
x-y,-y,-z+1 |
5_556 |
3 |
1 |
32484 |
34.3 |
1.3 |
0.341 |
0 |
0 |
0 |
0.000 |
52 |
63 |
|
[PGE]F:1784 |
2 |
1 |
332 |
f |
A |
x,y,z |
1_555 |
4 |
1 |
32160 |
22.0 |
-0.1 |
0.240 |
0 |
0 |
0 |
0.000 |
53 |
64 |
|
D |
3 |
1 |
32820 |
◊ |
C |
x-y,-y,-z |
5_555 |
3 |
1 |
32484 |
19.9 |
-0.2 |
0.443 |
0 |
0 |
0 |
0.000 |
54 |
65 |
|
D |
1 |
1 |
32820 |
◊ |
C |
x,y,z-1 |
1_554 |
1 |
1 |
32484 |
15.1 |
-0.1 |
0.336 |
0 |
0 |
0 |
0.000 |
55 |
66 |
|
[EDO]B:1787 |
1 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
32160 |
13.2 |
-0.1 |
0.395 |
0 |
0 |
0 |
0.000 |
56 |
67 |
|
A |
1 |
1 |
32160 |
◊ |
A |
y,x,-z+1 |
4_556 |
1 |
1 |
32160 |
0.2 |
0.0 |
0.631 |
0 |
0 |
0 |
0.000 |
|