| ## |
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 |
74 |
18 |
3014 |
◊ |
B |
x,y,z |
1_555 |
75 |
17 |
3249 |
630.1 |
-6.1 |
0.843 |
11 |
1 |
0 |
0.248 |
| 2 |
2 |
|
D |
63 |
17 |
3014 |
◊ |
C |
x,y,z |
1_555 |
59 |
13 |
2029 |
602.8 |
-11.9 |
0.399 |
9 |
2 |
2 |
1.000 |
| 3 |
3 |
|
B |
56 |
17 |
3249 |
◊ |
A |
x,y,z |
1_555 |
45 |
12 |
2164 |
497.9 |
-12.0 |
0.188 |
6 |
2 |
2 |
1.000 |
| 4 |
4 |
|
A |
24 |
7 |
2164 |
◊ |
D |
-x+y-1/3,-x+1/3,z+1/3 |
6_455 |
18 |
4 |
3014 |
173.3 |
-2.4 |
0.536 |
0 |
0 |
0 |
0.000 |
| 5 |
5 |
|
A |
20 |
5 |
2164 |
◊ |
C |
-x+y-1/3,-x+1/3,z+1/3 |
6_455 |
21 |
6 |
2029 |
164.8 |
-0.5 |
0.816 |
0 |
2 |
0 |
0.000 |
| 6 |
6 |
|
A |
20 |
6 |
2164 |
◊ |
B |
-y,x-y,z |
2_555 |
19 |
3 |
3249 |
158.4 |
-2.6 |
0.591 |
0 |
0 |
0 |
0.043 |
| 7 |
7 |
|
D |
15 |
3 |
3014 |
◊ |
C |
-y,x-y,z |
2_555 |
15 |
5 |
2029 |
119.7 |
-2.9 |
0.439 |
0 |
0 |
0 |
0.046 |
| 8 |
8 |
|
[CRS]D:34 |
8 |
1 |
262 |
◊ |
B |
x,y,z |
1_555 |
17 |
4 |
3249 |
118.9 |
3.8 |
0.108 |
0 |
0 |
0 |
0.000 |
| 9 |
9 |
|
D |
12 |
6 |
3014 |
x |
D |
-y,x-y,z |
2_555 |
19 |
5 |
3014 |
114.1 |
-3.3 |
0.248 |
0 |
0 |
0 |
0.091 |
10 |
|
B |
15 |
4 |
3249 |
x |
B |
-y,x-y,z |
2_555 |
10 |
5 |
3249 |
108.6 |
-2.9 |
0.279 |
0 |
0 |
0 |
0.091 |
| Average: |
111.4 |
-3.1 |
0.264 |
0 |
0 |
0 |
0.091 |
| 10 |
11 |
|
D |
12 |
3 |
3014 |
◊ |
A |
x,y,z-1 |
1_554 |
12 |
3 |
2164 |
103.8 |
-0.7 |
0.716 |
1 |
0 |
0 |
0.000 |
| 11 |
12 |
|
A |
12 |
4 |
2164 |
◊ |
B |
-x+y-1/3,-x+1/3,z+1/3 |
6_455 |
8 |
2 |
3249 |
95.6 |
-0.7 |
0.510 |
0 |
0 |
0 |
0.000 |
| 12 |
13 |
|
B |
15 |
4 |
3249 |
◊ |
D |
-y,x-y,z |
2_555 |
11 |
5 |
3014 |
85.9 |
-2.2 |
0.383 |
0 |
0 |
0 |
0.053 |
| 13 |
14 |
|
[CRS]D:35 |
7 |
1 |
262 |
◊ |
C |
x,y,z |
1_555 |
11 |
3 |
2029 |
83.4 |
2.4 |
0.082 |
0 |
0 |
0 |
0.000 |
| 14 |
15 |
|
A |
15 |
4 |
2164 |
◊ |
[CRS]D:35 |
-y,x-y,z |
2_555 |
8 |
1 |
262 |
82.2 |
2.0 |
0.012 |
0 |
0 |
0 |
0.000 |
| 15 |
16 |
|
C |
9 |
3 |
2029 |
◊ |
B |
x,y,z-1 |
1_554 |
14 |
3 |
3249 |
81.6 |
-1.0 |
0.631 |
1 |
0 |
0 |
0.000 |
| 16 |
17 |
|
[CRS]A:22 |
7 |
1 |
263 |
◊ |
A |
x,y,z |
1_555 |
13 |
6 |
2164 |
81.0 |
1.9 |
0.083 |
2 |
0 |
0 |
0.000 |
18 |
|
[CRS]C:22 |
7 |
1 |
262 |
◊ |
C |
x,y,z |
1_555 |
13 |
6 |
2029 |
78.6 |
1.6 |
0.095 |
2 |
0 |
0 |
0.000 |
| Average: |
79.8 |
1.8 |
0.089 |
2 |
0 |
0 |
0.000 |
| 17 |
19 |
|
B |
11 |
4 |
3249 |
◊ |
[CRS]D:33 |
-y,x-y,z |
2_555 |
8 |
1 |
260 |
79.3 |
2.4 |
0.070 |
0 |
0 |
0 |
0.000 |
| 18 |
20 |
|
[CRS]D:33 |
7 |
1 |
260 |
◊ |
D |
x,y,z |
1_555 |
12 |
4 |
3014 |
77.6 |
2.4 |
0.142 |
1 |
0 |
0 |
0.000 |
| 19 |
21 |
|
[CRS]A:22 |
8 |
1 |
263 |
◊ |
B |
x,y,z |
1_555 |
11 |
4 |
3249 |
76.6 |
1.5 |
0.049 |
0 |
0 |
0 |
0.000 |
| 20 |
22 |
|
[CRS]C:22 |
8 |
1 |
262 |
◊ |
D |
x,y,z |
1_555 |
10 |
4 |
3014 |
67.6 |
1.2 |
0.024 |
0 |
0 |
0 |
0.000 |
| 21 |
23 |
|
D |
9 |
3 |
3014 |
◊ |
[CRS]C:22 |
-y,x-y,z |
2_555 |
8 |
1 |
262 |
63.9 |
0.5 |
0.004 |
0 |
0 |
0 |
0.000 |
| 22 |
24 |
|
[CRS]A:22 |
8 |
1 |
263 |
◊ |
B |
-y,x-y,z |
2_555 |
5 |
3 |
3249 |
63.7 |
0.9 |
0.004 |
0 |
0 |
0 |
0.000 |
| 23 |
25 |
|
B |
5 |
3 |
3249 |
◊ |
C |
x,y,z |
1_555 |
4 |
1 |
2029 |
58.3 |
0.0 |
0.596 |
0 |
0 |
0 |
0.000 |
| 24 |
26 |
|
B |
8 |
2 |
3249 |
◊ |
C |
-y,x-y,z |
2_555 |
4 |
2 |
2029 |
56.9 |
-1.7 |
0.264 |
0 |
0 |
0 |
0.040 |
| 25 |
27 |
|
A |
8 |
3 |
2164 |
◊ |
D |
-y,x-y,z |
2_555 |
9 |
3 |
3014 |
56.1 |
-1.2 |
0.434 |
0 |
0 |
0 |
0.028 |
| 26 |
28 |
|
[CRS]D:34 |
4 |
1 |
262 |
f |
D |
x,y,z |
1_555 |
8 |
5 |
3014 |
53.7 |
1.1 |
0.055 |
2 |
0 |
0 |
0.000 |
| 27 |
29 |
|
D |
7 |
3 |
3014 |
f |
[CRS]D:33 |
-y,x-y,z |
2_555 |
5 |
1 |
260 |
51.1 |
0.6 |
0.051 |
1 |
0 |
0 |
0.000 |
| 28 |
30 |
|
[CL]D:32 |
1 |
1 |
125 |
x |
D |
x,y,z |
1_555 |
7 |
2 |
3014 |
49.5 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.204 |
31 |
|
[CL]B:32 |
1 |
1 |
125 |
x |
B |
x,y,z |
1_555 |
6 |
2 |
3249 |
48.9 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.204 |
| Average: |
49.2 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.204 |
| 29 |
32 |
|
[CRS]D:35 |
6 |
1 |
262 |
◊ |
D |
x,y,z |
1_555 |
6 |
3 |
3014 |
48.2 |
1.2 |
0.000 |
1 |
0 |
0 |
0.000 |
| 30 |
33 |
|
C |
3 |
2 |
2029 |
◊ |
B |
-y+2/3,x-y+1/3,z-2/3 |
5_554 |
4 |
1 |
3249 |
47.1 |
0.7 |
0.477 |
0 |
0 |
0 |
0.000 |
| 31 |
34 |
|
B |
2 |
1 |
3249 |
◊ |
D |
-x+y-1/3,-x+1/3,z+1/3 |
6_455 |
4 |
1 |
3014 |
46.7 |
1.3 |
0.898 |
2 |
0 |
0 |
0.000 |
| 32 |
35 |
|
[CRS]D:34 |
3 |
1 |
262 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
2164 |
46.4 |
1.0 |
0.194 |
0 |
0 |
0 |
0.000 |
| 33 |
36 |
|
[ZN]B:31 |
1 |
1 |
98 |
x |
B |
x,y,z |
1_555 |
7 |
3 |
3249 |
40.2 |
-22.0 |
0.000 |
0 |
0 |
0 |
0.604 |
37 |
|
[ZN]D:31 |
1 |
1 |
98 |
x |
D |
x,y,z |
1_555 |
6 |
2 |
3014 |
38.6 |
-21.9 |
0.000 |
0 |
0 |
0 |
0.604 |
| Average: |
39.4 |
-21.9 |
0.000 |
0 |
0 |
0 |
0.604 |
| 34 |
38 |
|
D |
4 |
2 |
3014 |
◊ |
B |
-y,x-y,z-1 |
2_554 |
4 |
3 |
3249 |
37.1 |
0.8 |
0.864 |
0 |
0 |
0 |
0.000 |
| 35 |
39 |
|
[CL]D:32 |
1 |
1 |
125 |
f |
[ZN]D:31 |
x,y,z |
1_555 |
1 |
1 |
98 |
35.3 |
-19.1 |
0.000 |
0 |
0 |
0 |
0.176 |
| 36 |
40 |
|
[CL]B:32 |
1 |
1 |
125 |
f |
[ZN]B:31 |
x,y,z |
1_555 |
1 |
1 |
98 |
33.1 |
-17.4 |
0.000 |
0 |
0 |
0 |
0.156 |
| 37 |
41 |
|
A |
3 |
2 |
2164 |
◊ |
C |
-y,x-y,z |
2_555 |
4 |
2 |
2029 |
32.9 |
-0.3 |
0.503 |
0 |
0 |
0 |
0.008 |
| 38 |
42 |
|
[CRS]A:22 |
1 |
1 |
263 |
f |
D |
-y,x-y,z |
2_555 |
2 |
1 |
3014 |
23.0 |
0.4 |
0.476 |
0 |
0 |
0 |
0.000 |
| 39 |
43 |
|
A |
3 |
1 |
2164 |
x |
A |
-x+y-1/3,-x+1/3,z+1/3 |
6_455 |
3 |
1 |
2164 |
21.3 |
0.3 |
0.752 |
0 |
0 |
0 |
0.000 |
| 40 |
44 |
|
B |
1 |
1 |
3249 |
f |
[CRS]C:22 |
-y,x-y,z |
2_555 |
1 |
1 |
262 |
19.8 |
0.4 |
0.286 |
0 |
0 |
0 |
0.000 |
| 41 |
45 |
|
[CRS]D:33 |
3 |
1 |
260 |
◊ |
[CRS]C:22 |
x,y,z |
1_555 |
3 |
1 |
262 |
18.4 |
1.0 |
0.000 |
0 |
0 |
0 |
0.000 |
| 42 |
46 |
|
B |
1 |
1 |
3249 |
f |
[CRS]D:35 |
-y,x-y,z |
2_555 |
2 |
1 |
262 |
18.3 |
0.3 |
0.130 |
0 |
0 |
0 |
0.000 |
| 43 |
47 |
|
C |
3 |
1 |
2029 |
◊ |
A |
x,y,z-1 |
1_554 |
1 |
1 |
2164 |
16.6 |
0.1 |
0.697 |
0 |
0 |
0 |
0.000 |
| 44 |
48 |
|
D |
3 |
1 |
3014 |
◊ |
B |
-x+y-1/3,-x+1/3,z-2/3 |
6_454 |
3 |
1 |
3249 |
16.5 |
0.2 |
0.676 |
0 |
0 |
0 |
0.000 |
| 45 |
49 |
|
D |
3 |
1 |
3014 |
◊ |
B |
x,y,z-1 |
1_554 |
2 |
1 |
3249 |
13.1 |
0.2 |
0.778 |
0 |
0 |
0 |
0.000 |
| 46 |
50 |
|
B |
1 |
1 |
3249 |
◊ |
C |
-x+y-1/3,-x+1/3,z+1/3 |
6_455 |
3 |
2 |
2029 |
10.0 |
0.4 |
0.831 |
0 |
0 |
0 |
0.000 |
| 47 |
51 |
|
D |
3 |
1 |
3014 |
◊ |
C |
-y+2/3,x-y+1/3,z+1/3 |
5_555 |
1 |
1 |
2029 |
9.5 |
-0.0 |
0.707 |
0 |
0 |
0 |
0.000 |
| 48 |
52 |
|
D |
3 |
2 |
3014 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
2164 |
8.6 |
0.2 |
0.746 |
0 |
0 |
0 |
0.000 |
| 49 |
53 |
|
B |
1 |
1 |
3249 |
x |
B |
-x+y-1/3,-x+1/3,z-2/3 |
6_454 |
1 |
1 |
3249 |
3.2 |
0.1 |
0.770 |
0 |
0 |
0 |
0.000 |
| 50 |
54 |
|
A |
1 |
1 |
2164 |
◊ |
C |
-y,x-y,z+1 |
2_556 |
1 |
1 |
2029 |
2.3 |
-0.1 |
0.510 |
0 |
0 |
0 |
0.000 |
|