## |
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 |
|
B |
851 |
224 |
24181 |
◊ |
A |
x,y,z |
1_555 |
820 |
207 |
22214 |
8423.7 |
-114.9 |
0.000 |
104 |
32 |
0 |
0.973 |
2 |
|
H |
845 |
222 |
24045 |
◊ |
G |
x,y,z |
1_555 |
834 |
209 |
22349 |
8417.7 |
-116.6 |
0.000 |
102 |
32 |
0 |
0.973 |
3 |
|
F |
860 |
222 |
24137 |
◊ |
E |
x,y,z |
1_555 |
836 |
205 |
22353 |
8411.9 |
-116.8 |
0.000 |
100 |
32 |
0 |
0.973 |
4 |
|
D |
863 |
226 |
24052 |
◊ |
C |
x,y,z |
1_555 |
821 |
207 |
22314 |
8388.7 |
-115.4 |
0.000 |
106 |
34 |
0 |
0.973 |
Average: |
8410.5 |
-115.9 |
0.000 |
103 |
33 |
0 |
0.973 |
2 |
5 |
|
H |
123 |
33 |
24045 |
◊ |
F |
x,y,z |
1_555 |
119 |
33 |
24137 |
1038.5 |
3.9 |
0.892 |
23 |
20 |
0 |
0.024 |
6 |
|
D |
120 |
33 |
24052 |
◊ |
B |
x,y,z |
1_555 |
120 |
33 |
24181 |
1037.3 |
3.6 |
0.885 |
22 |
19 |
0 |
0.024 |
Average: |
1037.9 |
3.7 |
0.888 |
23 |
20 |
0 |
0.024 |
3 |
7 |
|
C |
78 |
23 |
22314 |
◊ |
A |
x,y,z |
1_555 |
80 |
23 |
22214 |
724.8 |
1.8 |
0.922 |
11 |
18 |
0 |
0.021 |
8 |
|
G |
78 |
23 |
22349 |
◊ |
E |
x,y,z |
1_555 |
78 |
22 |
22353 |
715.1 |
-0.5 |
0.863 |
11 |
18 |
0 |
0.021 |
Average: |
720.0 |
0.7 |
0.892 |
11 |
18 |
0 |
0.021 |
4 |
9 |
|
F |
86 |
23 |
24137 |
◊ |
G |
x,y,z |
1_555 |
70 |
23 |
22349 |
674.6 |
-7.0 |
0.329 |
6 |
4 |
0 |
0.053 |
10 |
|
B |
80 |
23 |
24181 |
◊ |
C |
x,y,z |
1_555 |
72 |
22 |
22314 |
670.8 |
-6.8 |
0.323 |
5 |
4 |
0 |
0.053 |
11 |
|
H |
80 |
22 |
24045 |
◊ |
E |
x,y,z |
1_555 |
70 |
21 |
22353 |
670.2 |
-6.4 |
0.364 |
5 |
4 |
0 |
0.053 |
12 |
|
D |
81 |
22 |
24052 |
◊ |
A |
x,y,z |
1_555 |
73 |
22 |
22214 |
660.3 |
-6.8 |
0.325 |
7 |
4 |
0 |
0.053 |
Average: |
669.0 |
-6.8 |
0.336 |
6 |
4 |
0 |
0.053 |
5 |
13 |
|
C |
51 |
15 |
22314 |
◊ |
F |
-x+3/2,-y,z-1/2 |
2_654 |
62 |
20 |
24137 |
512.7 |
-0.2 |
0.737 |
9 |
7 |
0 |
0.000 |
14 |
|
B |
64 |
21 |
24181 |
◊ |
G |
-x+3/2,-y,z-1/2 |
2_654 |
48 |
15 |
22349 |
497.9 |
-0.6 |
0.733 |
5 |
7 |
0 |
0.000 |
Average: |
505.3 |
-0.4 |
0.735 |
7 |
7 |
0 |
0.000 |
6 |
15 |
|
A |
35 |
13 |
22214 |
◊ |
E |
x-1/2,-y+1/2,-z+1 |
4_456 |
25 |
5 |
22353 |
285.0 |
1.0 |
0.815 |
1 |
0 |
0 |
0.000 |
7 |
16 |
|
C |
31 |
5 |
22314 |
◊ |
G |
x-1/2,-y+1/2,-z+1 |
4_456 |
32 |
11 |
22349 |
256.8 |
1.1 |
0.800 |
3 |
4 |
0 |
0.000 |
17 |
|
E |
21 |
7 |
22353 |
◊ |
A |
x,y,z |
1_555 |
23 |
4 |
22214 |
198.0 |
1.3 |
0.836 |
1 |
1 |
0 |
0.000 |
Average: |
227.4 |
1.2 |
0.818 |
2 |
3 |
0 |
0.000 |
8 |
18 |
|
[PLP]H:4475 |
15 |
1 |
388 |
f |
H |
x,y,z |
1_555 |
32 |
17 |
24045 |
204.7 |
-1.1 |
0.457 |
8 |
0 |
0 |
0.233 |
19 |
|
[PLP]D:2475 |
15 |
1 |
388 |
f |
D |
x,y,z |
1_555 |
32 |
17 |
24052 |
201.4 |
-0.6 |
0.510 |
6 |
0 |
0 |
0.233 |
20 |
|
[PLP]F:3475 |
15 |
1 |
387 |
f |
F |
x,y,z |
1_555 |
33 |
18 |
24137 |
201.0 |
-0.7 |
0.503 |
8 |
0 |
0 |
0.233 |
21 |
|
[PLP]B:1475 |
15 |
1 |
389 |
f |
B |
x,y,z |
1_555 |
33 |
17 |
24181 |
200.6 |
-0.6 |
0.525 |
8 |
0 |
0 |
0.233 |
Average: |
201.9 |
-0.7 |
0.499 |
8 |
0 |
0 |
0.233 |
9 |
22 |
|
A |
24 |
8 |
22214 |
◊ |
H |
x-1/2,-y+1/2,-z+1 |
4_456 |
18 |
4 |
24045 |
172.2 |
0.8 |
0.780 |
3 |
1 |
0 |
0.000 |
10 |
23 |
|
B |
21 |
10 |
24181 |
◊ |
H |
x-1/2,-y+1/2,-z+1 |
4_456 |
28 |
11 |
24045 |
166.9 |
2.5 |
0.866 |
0 |
3 |
0 |
0.000 |
24 |
|
F |
10 |
5 |
24137 |
◊ |
D |
x,y,z |
1_555 |
9 |
4 |
24052 |
52.7 |
1.1 |
0.807 |
0 |
0 |
0 |
0.000 |
Average: |
109.8 |
1.8 |
0.836 |
0 |
2 |
0 |
0.000 |
11 |
25 |
|
F |
17 |
4 |
24137 |
◊ |
C |
x,y,z |
1_555 |
24 |
6 |
22314 |
160.1 |
0.4 |
0.732 |
3 |
0 |
0 |
0.000 |
12 |
26 |
|
H |
17 |
3 |
24045 |
◊ |
D |
-x+2,y-1/2,-z+1/2 |
3_745 |
14 |
3 |
24052 |
115.0 |
0.1 |
0.665 |
1 |
1 |
0 |
0.000 |
13 |
27 |
|
B |
12 |
5 |
24181 |
◊ |
E |
x,y,z |
1_555 |
15 |
8 |
22353 |
100.8 |
1.6 |
0.850 |
1 |
3 |
0 |
0.000 |
14 |
28 |
|
[AOA]F:3476 |
6 |
1 |
217 |
◊ |
E |
x,y,z |
1_555 |
15 |
6 |
22353 |
86.8 |
1.5 |
0.342 |
4 |
0 |
0 |
0.003 |
29 |
|
[AOA]D:2476 |
6 |
1 |
214 |
◊ |
C |
x,y,z |
1_555 |
15 |
7 |
22314 |
82.2 |
1.6 |
0.451 |
5 |
0 |
0 |
0.003 |
30 |
|
[AOA]B:1476 |
6 |
1 |
215 |
◊ |
A |
x,y,z |
1_555 |
11 |
6 |
22214 |
82.1 |
1.5 |
0.384 |
4 |
0 |
0 |
0.003 |
Average: |
83.7 |
1.5 |
0.392 |
4 |
0 |
0 |
0.003 |
15 |
31 |
|
[AOA]H:4476 |
6 |
1 |
215 |
◊ |
G |
x,y,z |
1_555 |
14 |
7 |
22349 |
83.1 |
1.6 |
0.394 |
4 |
0 |
0 |
0.001 |
16 |
32 |
|
[PLP]H:4475 |
7 |
1 |
388 |
◊ |
G |
x,y,z |
1_555 |
11 |
5 |
22349 |
75.6 |
-1.5 |
0.437 |
2 |
0 |
0 |
0.015 |
33 |
|
[PLP]F:3475 |
7 |
1 |
387 |
◊ |
E |
x,y,z |
1_555 |
12 |
5 |
22353 |
74.2 |
-1.7 |
0.427 |
2 |
0 |
0 |
0.015 |
34 |
|
[PLP]B:1475 |
7 |
1 |
389 |
◊ |
A |
x,y,z |
1_555 |
12 |
5 |
22214 |
73.3 |
-1.6 |
0.433 |
2 |
0 |
0 |
0.015 |
35 |
|
[PLP]D:2475 |
6 |
1 |
388 |
◊ |
C |
x,y,z |
1_555 |
11 |
4 |
22314 |
70.8 |
-1.7 |
0.394 |
2 |
0 |
0 |
0.015 |
Average: |
73.5 |
-1.6 |
0.423 |
2 |
0 |
0 |
0.015 |
17 |
36 |
|
G |
4 |
1 |
22349 |
◊ |
C |
-x+2,y-1/2,-z+1/2 |
3_745 |
11 |
3 |
22314 |
63.7 |
-1.5 |
0.186 |
0 |
0 |
0 |
0.000 |
18 |
37 |
|
[AOA]B:1476 |
5 |
1 |
215 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
24181 |
61.4 |
0.7 |
0.139 |
0 |
0 |
0 |
0.000 |
38 |
|
[AOA]H:4476 |
5 |
1 |
215 |
f |
H |
x,y,z |
1_555 |
8 |
4 |
24045 |
60.7 |
0.6 |
0.131 |
0 |
0 |
0 |
0.000 |
39 |
|
[AOA]D:2476 |
6 |
1 |
214 |
f |
D |
x,y,z |
1_555 |
9 |
4 |
24052 |
60.4 |
0.7 |
0.072 |
0 |
0 |
0 |
0.000 |
Average: |
60.8 |
0.7 |
0.114 |
0 |
0 |
0 |
0.000 |
19 |
40 |
|
[AOA]F:3476 |
5 |
1 |
217 |
f |
F |
x,y,z |
1_555 |
10 |
4 |
24137 |
60.3 |
0.7 |
0.129 |
0 |
0 |
0 |
0.000 |
20 |
41 |
|
B |
6 |
2 |
24181 |
◊ |
G |
x-1/2,-y+1/2,-z+1 |
4_456 |
6 |
2 |
22349 |
46.5 |
0.7 |
0.765 |
1 |
1 |
0 |
0.000 |
21 |
42 |
|
D |
7 |
3 |
24052 |
◊ |
G |
x-1/2,-y+1/2,-z+1 |
4_456 |
11 |
5 |
22349 |
44.7 |
1.3 |
0.846 |
1 |
1 |
0 |
0.000 |
22 |
43 |
|
[AOA]D:2476 |
3 |
1 |
214 |
cf |
[PLP]D:2475 |
x,y,z |
1_555 |
6 |
1 |
388 |
41.0 |
1.1 |
0.110 |
0 |
0 |
0 |
0.000 |
44 |
|
[AOA]H:4476 |
3 |
1 |
215 |
cf |
[PLP]H:4475 |
x,y,z |
1_555 |
4 |
1 |
388 |
40.7 |
1.1 |
0.116 |
0 |
0 |
0 |
0.000 |
45 |
|
[AOA]B:1476 |
3 |
1 |
215 |
cf |
[PLP]B:1475 |
x,y,z |
1_555 |
5 |
1 |
389 |
40.0 |
1.1 |
0.056 |
0 |
0 |
0 |
0.000 |
Average: |
40.6 |
1.1 |
0.094 |
0 |
0 |
0 |
0.000 |
23 |
46 |
|
[AOA]F:3476 |
2 |
1 |
217 |
cf |
[PLP]F:3475 |
x,y,z |
1_555 |
7 |
1 |
387 |
40.5 |
1.0 |
0.135 |
0 |
0 |
0 |
0.000 |
24 |
47 |
|
A |
4 |
2 |
22214 |
◊ |
H |
-x+3/2,-y,z-1/2 |
2_654 |
4 |
2 |
24045 |
30.9 |
-0.1 |
0.502 |
0 |
0 |
0 |
0.000 |
48 |
|
D |
2 |
2 |
24052 |
◊ |
E |
-x+3/2,-y,z-1/2 |
2_654 |
2 |
2 |
22353 |
6.2 |
-0.1 |
0.549 |
0 |
0 |
0 |
0.000 |
Average: |
18.6 |
-0.1 |
0.526 |
0 |
0 |
0 |
0.000 |
25 |
49 |
|
D |
5 |
2 |
24052 |
◊ |
E |
x,y,z |
1_555 |
3 |
2 |
22353 |
21.9 |
0.6 |
0.811 |
0 |
0 |
0 |
0.000 |
26 |
50 |
|
E |
2 |
2 |
22353 |
◊ |
D |
-x+2,y-1/2,-z+1/2 |
3_745 |
4 |
3 |
24052 |
19.8 |
0.3 |
0.719 |
0 |
0 |
0 |
0.000 |
27 |
51 |
|
E |
1 |
1 |
22353 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
22314 |
9.5 |
-0.1 |
0.442 |
0 |
0 |
0 |
0.000 |
|