| ## |
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 |
|
E |
234 |
73 |
18154 |
◊ |
D |
x,y,z |
1_555 |
243 |
74 |
18116 |
2325.5 |
-27.8 |
0.069 |
31 |
4 |
0 |
0.261 |
2 |
|
C |
244 |
74 |
18168 |
◊ |
A |
x,y,z |
1_555 |
230 |
71 |
18120 |
2312.9 |
-28.3 |
0.049 |
32 |
4 |
0 |
0.261 |
3 |
|
F |
237 |
73 |
18135 |
◊ |
E |
x,y,z |
1_555 |
238 |
74 |
18154 |
2312.4 |
-27.7 |
0.064 |
32 |
4 |
0 |
0.261 |
4 |
|
B |
232 |
72 |
18081 |
◊ |
A |
x,y,z |
1_555 |
247 |
74 |
18120 |
2309.6 |
-26.9 |
0.079 |
30 |
4 |
0 |
0.261 |
5 |
|
C |
237 |
72 |
18168 |
◊ |
B |
x,y,z |
1_555 |
242 |
73 |
18081 |
2303.7 |
-28.3 |
0.049 |
30 |
4 |
0 |
0.261 |
6 |
|
F |
244 |
74 |
18135 |
◊ |
D |
x,y,z |
1_555 |
238 |
72 |
18116 |
2299.6 |
-28.9 |
0.056 |
33 |
4 |
0 |
0.261 |
| Average: |
2310.6 |
-28.0 |
0.061 |
31 |
4 |
0 |
0.261 |
| 2 |
7 |
|
D |
100 |
36 |
18116 |
◊ |
E |
-y,x,z+1/4 |
3_555 |
110 |
40 |
18154 |
888.6 |
3.4 |
0.948 |
7 |
8 |
0 |
0.000 |
| 3 |
8 |
|
F |
86 |
33 |
18135 |
◊ |
C |
-x,-y+1,z-1/2 |
2_564 |
77 |
31 |
18168 |
697.5 |
5.4 |
0.962 |
7 |
5 |
0 |
0.000 |
| 4 |
9 |
|
B |
70 |
26 |
18081 |
◊ |
A |
-y+1,x,z+1/4 |
3_655 |
70 |
25 |
18120 |
595.8 |
5.2 |
0.968 |
7 |
8 |
0 |
0.000 |
| 5 |
10 |
|
E |
47 |
15 |
18154 |
◊ |
C |
x,y,z |
1_555 |
47 |
15 |
18168 |
457.8 |
-5.3 |
0.292 |
3 |
0 |
0 |
0.020 |
11 |
|
F |
47 |
15 |
18135 |
◊ |
B |
x,y,z |
1_555 |
47 |
15 |
18081 |
453.0 |
-5.5 |
0.275 |
3 |
0 |
0 |
0.020 |
12 |
|
D |
47 |
14 |
18116 |
◊ |
A |
x,y,z |
1_555 |
49 |
15 |
18120 |
449.7 |
-5.2 |
0.301 |
3 |
0 |
0 |
0.020 |
| Average: |
453.5 |
-5.3 |
0.289 |
3 |
0 |
0 |
0.020 |
| 6 |
13 |
|
[K]D:5503 |
1 |
1 |
216 |
f |
D |
x,y,z |
1_555 |
19 |
7 |
18116 |
106.1 |
-76.1 |
0.000 |
0 |
0 |
0 |
0.463 |
14 |
|
[K]A:2503 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
19 |
7 |
18120 |
105.8 |
-76.2 |
0.000 |
0 |
0 |
0 |
0.463 |
15 |
|
[K]F:7503 |
1 |
1 |
216 |
f |
F |
x,y,z |
1_555 |
20 |
7 |
18135 |
105.3 |
-76.5 |
0.000 |
0 |
0 |
0 |
0.463 |
16 |
|
[K]E:6503 |
1 |
1 |
216 |
f |
E |
x,y,z |
1_555 |
20 |
7 |
18154 |
104.5 |
-76.3 |
0.000 |
0 |
0 |
0 |
0.463 |
17 |
|
[K]C:4503 |
1 |
1 |
216 |
f |
C |
x,y,z |
1_555 |
18 |
6 |
18168 |
104.2 |
-75.9 |
0.000 |
0 |
0 |
0 |
0.463 |
18 |
|
[K]B:3503 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
18 |
6 |
18081 |
103.9 |
-75.0 |
0.000 |
0 |
0 |
0 |
0.463 |
| Average: |
105.0 |
-76.0 |
0.000 |
0 |
0 |
0 |
0.463 |
| 7 |
19 |
|
[K]B:3503 |
1 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
5 |
3 |
18168 |
64.7 |
-33.9 |
0.000 |
0 |
0 |
0 |
0.202 |
20 |
|
[K]D:5503 |
1 |
1 |
216 |
◊ |
E |
x,y,z |
1_555 |
6 |
3 |
18154 |
62.7 |
-32.8 |
0.000 |
0 |
0 |
0 |
0.202 |
21 |
|
[K]C:4503 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
18120 |
62.0 |
-33.0 |
0.000 |
0 |
0 |
0 |
0.202 |
22 |
|
[K]E:6503 |
1 |
1 |
216 |
◊ |
F |
x,y,z |
1_555 |
5 |
3 |
18135 |
61.9 |
-32.5 |
0.000 |
0 |
0 |
0 |
0.202 |
23 |
|
[K]A:2503 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
18081 |
61.7 |
-32.6 |
0.000 |
0 |
0 |
0 |
0.202 |
24 |
|
[K]F:7503 |
1 |
1 |
216 |
◊ |
D |
x,y,z |
1_555 |
4 |
3 |
18116 |
61.0 |
-32.3 |
0.000 |
0 |
0 |
0 |
0.202 |
| Average: |
62.3 |
-32.8 |
0.000 |
0 |
0 |
0 |
0.202 |
| 8 |
25 |
|
D |
6 |
2 |
18116 |
x |
D |
-y,x,z+1/4 |
3_555 |
5 |
2 |
18116 |
51.8 |
-0.8 |
0.319 |
0 |
0 |
0 |
0.000 |
26 |
|
E |
2 |
1 |
18154 |
x |
C |
-x,-y+1,z-1/2 |
2_564 |
2 |
1 |
18168 |
7.4 |
-0.2 |
0.406 |
0 |
0 |
0 |
0.000 |
| Average: |
29.6 |
-0.5 |
0.362 |
0 |
0 |
0 |
0.000 |
| 9 |
27 |
|
[CU]A:501 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
18120 |
47.0 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.044 |
28 |
|
[CU]B:501 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
18081 |
46.4 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.044 |
29 |
|
[CU]E:501 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
8 |
4 |
18154 |
46.4 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.044 |
30 |
|
[CU]C:501 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
8 |
4 |
18168 |
46.3 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.044 |
31 |
|
[CU]F:501 |
1 |
1 |
125 |
f |
F |
x,y,z |
1_555 |
8 |
4 |
18135 |
46.2 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.044 |
32 |
|
[CU]D:501 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
8 |
4 |
18116 |
45.6 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.044 |
| Average: |
46.3 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.044 |
| 10 |
33 |
|
[CU]F:501 |
1 |
1 |
125 |
◊ |
E |
x,y,z |
1_555 |
9 |
4 |
18154 |
46.2 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.035 |
34 |
|
[CU]B:501 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
18120 |
45.9 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.035 |
35 |
|
[CU]D:501 |
1 |
1 |
125 |
◊ |
F |
x,y,z |
1_555 |
9 |
4 |
18135 |
45.2 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.035 |
36 |
|
[CU]A:501 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
10 |
4 |
18168 |
45.1 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.035 |
37 |
|
[CU]E:501 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
8 |
4 |
18116 |
44.8 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.035 |
38 |
|
[CU]C:501 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
8 |
4 |
18081 |
44.6 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.035 |
| Average: |
45.3 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.035 |
| 11 |
39 |
|
B |
2 |
1 |
18081 |
x |
C |
-y+1,x,z+1/4 |
3_655 |
1 |
1 |
18168 |
3.1 |
-0.1 |
0.476 |
0 |
0 |
0 |
0.000 |
40 |
|
A |
1 |
1 |
18120 |
x |
A |
-y+1,x,z+1/4 |
3_655 |
1 |
1 |
18120 |
1.2 |
-0.0 |
0.492 |
0 |
0 |
0 |
0.000 |
| Average: |
2.1 |
-0.1 |
0.484 |
0 |
0 |
0 |
0.000 |
| 12 |
41 |
|
F |
1 |
1 |
18135 |
◊ |
B |
-x,-y+1,z-1/2 |
2_564 |
1 |
1 |
18081 |
0.3 |
-0.0 |
0.575 |
0 |
0 |
0 |
0.000 |
|