## |
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 |
185 |
53 |
16999 |
◊ |
C |
x,y,z |
1_555 |
179 |
45 |
6903 |
1675.3 |
-13.1 |
0.282 |
26 |
13 |
0 |
0.968 |
2 |
|
F |
185 |
52 |
16854 |
◊ |
E |
x,y,z |
1_555 |
170 |
41 |
6589 |
1622.6 |
-12.2 |
0.384 |
26 |
16 |
0 |
0.968 |
Average: |
1648.9 |
-12.6 |
0.333 |
26 |
15 |
0 |
0.968 |
2 |
3 |
|
D |
129 |
36 |
16999 |
◊ |
E |
x,y,z |
1_555 |
132 |
42 |
6589 |
1287.2 |
-7.0 |
0.215 |
23 |
4 |
0 |
0.953 |
4 |
|
F |
131 |
36 |
16854 |
◊ |
C |
x,y,z |
1_555 |
131 |
42 |
6903 |
1261.1 |
-8.3 |
0.152 |
21 |
3 |
0 |
0.953 |
Average: |
1274.1 |
-7.6 |
0.183 |
22 |
4 |
0 |
0.953 |
3 |
5 |
|
C |
102 |
31 |
6903 |
◊ |
A |
x,y,z |
1_555 |
82 |
29 |
16030 |
889.9 |
-8.1 |
0.290 |
12 |
5 |
0 |
0.197 |
6 |
|
E |
80 |
23 |
6589 |
◊ |
B |
x,y,z |
1_555 |
83 |
28 |
16036 |
812.0 |
-10.4 |
0.147 |
9 |
1 |
0 |
0.197 |
Average: |
851.0 |
-9.3 |
0.218 |
11 |
3 |
0 |
0.197 |
4 |
7 |
|
F |
68 |
21 |
16854 |
◊ |
D |
x,y,z |
1_555 |
71 |
20 |
16999 |
661.8 |
-1.2 |
0.612 |
6 |
14 |
0 |
0.062 |
5 |
8 |
|
[HEC]B:500 |
43 |
1 |
858 |
cf |
B |
x,y,z |
1_555 |
82 |
34 |
16036 |
631.6 |
-21.3 |
0.437 |
5 |
0 |
0 |
0.317 |
9 |
|
[HEC]A:500 |
43 |
1 |
859 |
cf |
A |
x,y,z |
1_555 |
76 |
33 |
16030 |
627.7 |
-20.7 |
0.480 |
6 |
0 |
0 |
0.317 |
Average: |
629.7 |
-21.0 |
0.459 |
6 |
0 |
0 |
0.317 |
6 |
10 |
|
[HEC]A:600 |
43 |
1 |
856 |
cf |
A |
x,y,z |
1_555 |
77 |
33 |
16030 |
605.4 |
-24.1 |
0.203 |
3 |
0 |
0 |
0.338 |
11 |
|
[HEC]B:600 |
43 |
1 |
845 |
cf |
B |
x,y,z |
1_555 |
80 |
33 |
16036 |
602.4 |
-23.7 |
0.207 |
3 |
0 |
0 |
0.338 |
Average: |
603.9 |
-23.9 |
0.205 |
3 |
0 |
0 |
0.338 |
7 |
12 |
|
D |
42 |
14 |
16999 |
◊ |
A |
x,y,z |
1_555 |
42 |
12 |
16030 |
410.8 |
0.5 |
0.704 |
5 |
4 |
0 |
0.017 |
13 |
|
F |
39 |
13 |
16854 |
◊ |
B |
x,y,z |
1_555 |
38 |
10 |
16036 |
397.6 |
0.1 |
0.639 |
4 |
2 |
0 |
0.017 |
Average: |
404.2 |
0.3 |
0.671 |
5 |
3 |
0 |
0.017 |
8 |
14 |
|
A |
38 |
14 |
16030 |
◊ |
B |
x,y,z-1 |
1_554 |
40 |
14 |
16036 |
322.2 |
0.1 |
0.691 |
2 |
7 |
0 |
0.010 |
9 |
15 |
|
E |
40 |
13 |
6589 |
◊ |
B |
x-1,y,z |
1_455 |
31 |
10 |
16036 |
320.9 |
-3.7 |
0.317 |
3 |
0 |
0 |
0.000 |
10 |
16 |
|
A |
35 |
13 |
16030 |
◊ |
F |
x,y-1,z-1 |
1_544 |
35 |
12 |
16854 |
284.1 |
-1.3 |
0.534 |
0 |
3 |
0 |
0.000 |
11 |
17 |
|
D |
28 |
7 |
16999 |
◊ |
B |
x,y,z |
1_555 |
31 |
8 |
16036 |
272.9 |
0.4 |
0.676 |
5 |
0 |
0 |
0.020 |
18 |
|
F |
27 |
7 |
16854 |
◊ |
A |
x,y,z |
1_555 |
31 |
8 |
16030 |
270.7 |
0.4 |
0.681 |
5 |
1 |
0 |
0.020 |
Average: |
271.8 |
0.4 |
0.678 |
5 |
1 |
0 |
0.020 |
12 |
19 |
|
C |
28 |
9 |
6903 |
◊ |
A |
x-1,y,z |
1_455 |
20 |
9 |
16030 |
241.1 |
-0.1 |
0.665 |
4 |
1 |
0 |
0.000 |
13 |
20 |
|
F |
22 |
7 |
16854 |
x |
F |
x-1,y,z |
1_455 |
21 |
6 |
16854 |
220.9 |
0.2 |
0.566 |
5 |
1 |
0 |
0.000 |
14 |
21 |
|
A |
20 |
7 |
16030 |
◊ |
B |
x,y-1,z-1 |
1_544 |
15 |
6 |
16036 |
162.9 |
-0.2 |
0.627 |
1 |
0 |
0 |
0.000 |
15 |
22 |
|
[PGE]B:374 |
9 |
1 |
322 |
f |
B |
x,y,z |
1_555 |
14 |
4 |
16036 |
123.6 |
2.9 |
0.227 |
2 |
0 |
0 |
0.000 |
16 |
23 |
|
F |
9 |
5 |
16854 |
◊ |
B |
x,y,z-1 |
1_554 |
8 |
3 |
16036 |
118.1 |
-0.5 |
0.411 |
2 |
1 |
0 |
0.012 |
24 |
|
A |
8 |
3 |
16030 |
◊ |
D |
x,y,z-1 |
1_554 |
11 |
5 |
16999 |
114.2 |
-0.1 |
0.575 |
1 |
2 |
0 |
0.012 |
Average: |
116.2 |
-0.3 |
0.493 |
2 |
2 |
0 |
0.012 |
17 |
25 |
|
[ACT]F:387 |
4 |
1 |
182 |
f |
F |
x,y,z |
1_555 |
14 |
4 |
16854 |
88.5 |
-0.1 |
0.678 |
3 |
0 |
0 |
0.100 |
18 |
26 |
|
[ACT]D:387 |
4 |
1 |
183 |
f |
D |
x,y,z |
1_555 |
12 |
4 |
16999 |
82.2 |
0.4 |
0.760 |
3 |
0 |
0 |
0.100 |
19 |
27 |
|
D |
11 |
4 |
16999 |
◊ |
B |
x-1,y,z |
1_455 |
9 |
3 |
16036 |
81.9 |
-1.4 |
0.274 |
0 |
0 |
0 |
0.000 |
20 |
28 |
|
D |
13 |
4 |
16999 |
◊ |
A |
x-1,y,z |
1_455 |
7 |
3 |
16030 |
77.5 |
-0.3 |
0.547 |
0 |
0 |
0 |
0.000 |
21 |
29 |
|
D |
7 |
4 |
16999 |
x |
D |
x-1,y,z |
1_455 |
11 |
5 |
16999 |
69.5 |
-1.0 |
0.367 |
0 |
0 |
0 |
0.000 |
22 |
30 |
|
D |
8 |
6 |
16999 |
◊ |
F |
x,y-1,z |
1_545 |
8 |
5 |
16854 |
52.2 |
1.0 |
0.772 |
0 |
0 |
0 |
0.000 |
23 |
31 |
|
[CA]B:400 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
12 |
8 |
16036 |
46.0 |
-11.2 |
0.000 |
0 |
0 |
0 |
0.151 |
32 |
|
[CA]A:400 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
11 |
8 |
16030 |
46.0 |
-11.2 |
0.000 |
0 |
0 |
0 |
0.151 |
Average: |
46.0 |
-11.2 |
0.000 |
0 |
0 |
0 |
0.151 |
24 |
33 |
|
A |
6 |
3 |
16030 |
x |
A |
x-1,y,z |
1_455 |
4 |
3 |
16030 |
38.6 |
-0.4 |
0.435 |
0 |
0 |
0 |
0.000 |
25 |
34 |
|
D |
5 |
2 |
16999 |
◊ |
F |
x-1,y-1,z |
1_445 |
4 |
2 |
16854 |
32.7 |
0.7 |
0.574 |
0 |
0 |
0 |
0.000 |
26 |
35 |
|
A |
3 |
1 |
16030 |
◊ |
B |
x-1,y-1,z-1 |
1_444 |
3 |
1 |
16036 |
13.7 |
-0.1 |
0.525 |
0 |
0 |
0 |
0.000 |
27 |
36 |
|
D |
3 |
1 |
16999 |
◊ |
B |
x-1,y-1,z-1 |
1_444 |
3 |
3 |
16036 |
9.5 |
-0.1 |
0.524 |
0 |
0 |
0 |
0.000 |
28 |
37 |
|
[HEC]B:600 |
3 |
1 |
845 |
f |
[CA]B:400 |
x,y,z |
1_555 |
1 |
1 |
85 |
9.2 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.024 |
38 |
|
[HEC]A:600 |
3 |
1 |
856 |
f |
[CA]A:400 |
x,y,z |
1_555 |
1 |
1 |
85 |
8.9 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.024 |
Average: |
9.0 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.024 |
29 |
39 |
|
[ACT]F:387 |
1 |
1 |
182 |
◊ |
B |
x,y,z-1 |
1_554 |
1 |
1 |
16036 |
6.4 |
-0.2 |
0.368 |
0 |
0 |
0 |
0.001 |
30 |
40 |
|
E |
2 |
1 |
6589 |
◊ |
F |
x-1,y,z |
1_455 |
1 |
1 |
16854 |
6.3 |
0.2 |
0.764 |
0 |
0 |
0 |
0.000 |
|