| ## |
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 |
155 |
41 |
9783 |
◊ |
C |
x,y,z |
1_555 |
158 |
41 |
9780 |
1630.7 |
-19.4 |
0.151 |
14 |
3 |
0 |
1.000 |
2 |
|
H |
155 |
41 |
9611 |
◊ |
G |
x,y,z |
1_555 |
154 |
41 |
9581 |
1595.8 |
-19.7 |
0.135 |
15 |
3 |
0 |
1.000 |
3 |
|
B |
152 |
41 |
9543 |
◊ |
A |
x,y,z |
1_555 |
154 |
41 |
9546 |
1580.9 |
-21.0 |
0.108 |
15 |
3 |
0 |
1.000 |
4 |
|
F |
154 |
41 |
9537 |
◊ |
E |
x,y,z |
1_555 |
154 |
42 |
9615 |
1569.3 |
-20.1 |
0.123 |
16 |
4 |
0 |
1.000 |
| Average: |
1594.2 |
-20.1 |
0.129 |
15 |
3 |
0 |
1.000 |
| 2 |
5 |
|
G |
126 |
38 |
9581 |
◊ |
E |
x,y,z |
1_555 |
121 |
37 |
9615 |
1206.7 |
-8.4 |
0.444 |
14 |
4 |
0 |
0.394 |
6 |
|
H |
126 |
38 |
9611 |
◊ |
F |
x,y,z |
1_555 |
127 |
38 |
9537 |
1184.7 |
-9.3 |
0.455 |
12 |
3 |
0 |
0.394 |
7 |
|
D |
120 |
38 |
9783 |
◊ |
B |
x,y,z |
1_555 |
121 |
37 |
9543 |
1164.1 |
-9.9 |
0.398 |
12 |
3 |
0 |
0.394 |
8 |
|
C |
120 |
38 |
9780 |
◊ |
A |
x,y,z |
1_555 |
121 |
38 |
9546 |
1140.0 |
-8.1 |
0.546 |
13 |
3 |
0 |
0.394 |
| Average: |
1173.9 |
-8.9 |
0.461 |
13 |
3 |
0 |
0.394 |
| 3 |
9 |
|
H |
69 |
17 |
9611 |
◊ |
F |
x-1,y,z |
1_455 |
61 |
16 |
9537 |
554.8 |
-7.1 |
0.312 |
5 |
0 |
0 |
0.016 |
| 4 |
10 |
|
B |
61 |
15 |
9543 |
◊ |
C |
x-1,y,z |
1_455 |
61 |
15 |
9780 |
537.6 |
-4.8 |
0.448 |
4 |
0 |
0 |
0.121 |
| 5 |
11 |
|
E |
42 |
13 |
9615 |
◊ |
B |
x,y,z |
1_555 |
42 |
13 |
9543 |
444.8 |
-4.4 |
0.360 |
1 |
0 |
0 |
0.000 |
| 6 |
12 |
|
D |
42 |
11 |
9783 |
◊ |
H |
x,y,z-1 |
1_554 |
43 |
12 |
9611 |
439.1 |
-6.8 |
0.172 |
0 |
0 |
0 |
0.000 |
| 7 |
13 |
|
A |
41 |
13 |
9546 |
◊ |
F |
x,y-1,z-1 |
1_544 |
44 |
14 |
9537 |
436.0 |
-4.2 |
0.409 |
2 |
0 |
0 |
0.000 |
| 8 |
14 |
|
A |
27 |
7 |
9546 |
◊ |
D |
x-1,y,z |
1_455 |
28 |
7 |
9783 |
232.4 |
-1.2 |
0.598 |
0 |
0 |
0 |
0.023 |
| 9 |
15 |
|
G |
24 |
8 |
9581 |
◊ |
F |
x-1,y,z |
1_455 |
27 |
7 |
9537 |
217.7 |
-0.3 |
0.680 |
1 |
1 |
0 |
0.003 |
16 |
|
H |
25 |
6 |
9611 |
◊ |
E |
x-1,y,z |
1_455 |
27 |
7 |
9615 |
213.5 |
-0.4 |
0.663 |
1 |
1 |
0 |
0.003 |
| Average: |
215.6 |
-0.4 |
0.671 |
1 |
1 |
0 |
0.003 |
| 10 |
17 |
|
[EPE]F:201 |
12 |
1 |
393 |
◊ |
F |
x,y,z |
1_555 |
21 |
9 |
9537 |
149.2 |
3.4 |
0.105 |
1 |
0 |
0 |
0.000 |
| 11 |
18 |
|
[PGE]B:201 |
10 |
1 |
332 |
◊ |
C |
x-1,y,z |
1_455 |
20 |
4 |
9780 |
129.8 |
2.6 |
0.180 |
0 |
0 |
0 |
0.000 |
| 12 |
19 |
|
[PEG]C:201 |
7 |
1 |
255 |
◊ |
C |
x,y,z |
1_555 |
19 |
6 |
9780 |
119.3 |
1.3 |
0.223 |
0 |
0 |
0 |
0.000 |
| 13 |
20 |
|
[PGE]E:301 |
9 |
1 |
332 |
◊ |
F |
x,y,z |
1_555 |
18 |
6 |
9537 |
106.5 |
2.2 |
0.144 |
1 |
0 |
0 |
0.000 |
| 14 |
21 |
|
[PGE]B:201 |
8 |
1 |
332 |
f |
B |
x,y,z |
1_555 |
15 |
4 |
9543 |
96.6 |
2.0 |
0.195 |
0 |
0 |
0 |
0.000 |
| 15 |
22 |
|
G |
12 |
5 |
9581 |
◊ |
E |
x-1,y,z |
1_455 |
12 |
5 |
9615 |
89.4 |
-0.8 |
0.538 |
2 |
0 |
0 |
0.003 |
| 16 |
23 |
|
[PGE]E:301 |
5 |
1 |
332 |
f |
E |
x,y,z |
1_555 |
11 |
4 |
9615 |
83.1 |
2.2 |
0.374 |
0 |
0 |
0 |
0.000 |
| 17 |
24 |
|
A |
11 |
4 |
9546 |
◊ |
H |
x,y-1,z-1 |
1_544 |
7 |
2 |
9611 |
76.1 |
0.6 |
0.761 |
1 |
2 |
0 |
0.000 |
25 |
|
C |
7 |
2 |
9780 |
◊ |
F |
x,y-1,z-1 |
1_544 |
5 |
2 |
9537 |
52.8 |
0.2 |
0.693 |
1 |
1 |
0 |
0.000 |
| Average: |
64.5 |
0.4 |
0.727 |
1 |
2 |
0 |
0.000 |
| 18 |
26 |
|
E |
16 |
6 |
9615 |
◊ |
D |
x,y,z |
1_555 |
7 |
2 |
9783 |
70.1 |
0.3 |
0.708 |
1 |
0 |
0 |
0.000 |
27 |
|
G |
4 |
2 |
9581 |
◊ |
B |
x,y,z |
1_555 |
9 |
3 |
9543 |
54.1 |
0.1 |
0.688 |
1 |
0 |
0 |
0.000 |
| Average: |
62.1 |
0.2 |
0.698 |
1 |
0 |
0 |
0.000 |
| 19 |
28 |
|
[EPE]F:201 |
9 |
1 |
393 |
f |
E |
x,y,z |
1_555 |
12 |
4 |
9615 |
67.4 |
1.1 |
0.011 |
0 |
0 |
0 |
0.000 |
| 20 |
29 |
|
D |
14 |
4 |
9783 |
◊ |
A |
x,y,z |
1_555 |
12 |
4 |
9546 |
66.6 |
-0.9 |
0.516 |
0 |
0 |
0 |
0.022 |
30 |
|
G |
14 |
3 |
9581 |
◊ |
F |
x,y,z |
1_555 |
11 |
3 |
9537 |
65.8 |
-0.8 |
0.518 |
0 |
0 |
0 |
0.022 |
31 |
|
H |
13 |
3 |
9611 |
◊ |
E |
x,y,z |
1_555 |
11 |
3 |
9615 |
65.2 |
-0.9 |
0.497 |
0 |
0 |
0 |
0.022 |
32 |
|
C |
13 |
3 |
9780 |
◊ |
B |
x,y,z |
1_555 |
11 |
3 |
9543 |
63.6 |
-0.7 |
0.522 |
0 |
0 |
0 |
0.022 |
| Average: |
65.3 |
-0.8 |
0.513 |
0 |
0 |
0 |
0.022 |
| 21 |
33 |
|
B |
7 |
3 |
9543 |
f |
[PEG]C:201 |
x-1,y,z |
1_455 |
2 |
1 |
255 |
40.4 |
0.8 |
0.464 |
1 |
0 |
0 |
0.000 |
| 22 |
34 |
|
[EPE]F:201 |
5 |
1 |
393 |
f |
[PGE]E:301 |
x,y,z |
1_555 |
5 |
1 |
332 |
30.8 |
1.7 |
0.033 |
0 |
0 |
0 |
0.000 |
| 23 |
35 |
|
B |
5 |
2 |
9543 |
◊ |
D |
x-1,y,z |
1_455 |
5 |
2 |
9783 |
30.0 |
0.2 |
0.692 |
0 |
0 |
0 |
0.000 |
36 |
|
A |
1 |
1 |
9546 |
◊ |
C |
x-1,y,z |
1_455 |
3 |
1 |
9780 |
17.6 |
0.1 |
0.665 |
0 |
0 |
0 |
0.000 |
| Average: |
23.8 |
0.2 |
0.679 |
0 |
0 |
0 |
0.000 |
| 24 |
37 |
|
[PEG]C:201 |
3 |
1 |
255 |
◊ |
D |
x,y,z |
1_555 |
4 |
3 |
9783 |
28.8 |
1.0 |
0.331 |
0 |
0 |
0 |
0.000 |
| 25 |
38 |
|
C |
2 |
1 |
9780 |
◊ |
E |
x,y-1,z |
1_545 |
1 |
1 |
9615 |
9.1 |
-0.1 |
0.446 |
0 |
0 |
0 |
0.000 |
| 26 |
39 |
|
D |
1 |
1 |
9783 |
◊ |
G |
x,y,z-1 |
1_554 |
1 |
1 |
9581 |
8.6 |
-0.0 |
0.488 |
0 |
0 |
0 |
0.000 |
|