## |
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 |
|
J |
90 |
23 |
8490 |
◊ |
H |
x,y,z |
1_555 |
92 |
23 |
8489 |
869.3 |
-11.2 |
0.196 |
14 |
12 |
0 |
1.000 |
2 |
|
L |
89 |
22 |
8514 |
◊ |
L |
-x,y,-z-1/2 |
3_554 |
89 |
22 |
8514 |
868.7 |
-11.5 |
0.197 |
14 |
12 |
0 |
1.000 |
3 |
|
G |
89 |
22 |
8392 |
◊ |
A |
-x,y,-z-1/2 |
3_554 |
91 |
23 |
8508 |
866.2 |
-11.4 |
0.200 |
15 |
12 |
0 |
1.000 |
4 |
|
K |
88 |
22 |
8517 |
◊ |
F |
x,y,z |
1_555 |
87 |
22 |
8380 |
863.1 |
-11.4 |
0.183 |
14 |
12 |
0 |
1.000 |
5 |
|
E |
90 |
23 |
8354 |
◊ |
B |
x,y,z |
1_555 |
91 |
22 |
8358 |
862.8 |
-11.3 |
0.245 |
14 |
12 |
0 |
1.000 |
6 |
|
I |
90 |
22 |
8521 |
◊ |
C |
x,y,z |
1_555 |
87 |
22 |
8456 |
861.9 |
-11.2 |
0.187 |
13 |
12 |
0 |
1.000 |
7 |
|
D |
86 |
21 |
8430 |
◊ |
D |
-x,y,-z-1/2 |
3_554 |
87 |
22 |
8430 |
855.6 |
-11.3 |
0.199 |
14 |
12 |
0 |
1.000 |
Average: |
863.9 |
-11.3 |
0.201 |
14 |
12 |
0 |
1.000 |
2 |
8 |
|
L |
58 |
15 |
8514 |
◊ |
A |
-x,y,-z-1/2 |
3_554 |
56 |
13 |
8508 |
521.7 |
-5.6 |
0.269 |
7 |
11 |
0 |
1.000 |
9 |
|
F |
58 |
14 |
8380 |
◊ |
C |
x,y,z |
1_555 |
56 |
12 |
8456 |
520.4 |
-5.5 |
0.303 |
7 |
11 |
0 |
1.000 |
10 |
|
K |
57 |
14 |
8517 |
◊ |
H |
x,y,z |
1_555 |
56 |
12 |
8489 |
519.5 |
-5.5 |
0.283 |
7 |
11 |
0 |
1.000 |
11 |
|
L |
56 |
12 |
8514 |
◊ |
B |
-x,y,-z-1/2 |
3_554 |
58 |
14 |
8358 |
519.2 |
-5.7 |
0.291 |
7 |
11 |
0 |
1.000 |
12 |
|
I |
57 |
12 |
8521 |
◊ |
G |
x,y,z |
1_555 |
57 |
15 |
8392 |
518.9 |
-5.4 |
0.295 |
7 |
11 |
0 |
1.000 |
13 |
|
H |
57 |
14 |
8489 |
◊ |
D |
x,y,z |
1_555 |
56 |
12 |
8430 |
518.7 |
-5.7 |
0.274 |
7 |
11 |
0 |
1.000 |
14 |
|
B |
55 |
12 |
8358 |
◊ |
A |
x,y,z |
1_555 |
56 |
14 |
8508 |
517.1 |
-5.3 |
0.335 |
7 |
11 |
0 |
1.000 |
15 |
|
K |
56 |
12 |
8517 |
◊ |
D |
x,y,z |
1_555 |
57 |
14 |
8430 |
515.6 |
-6.2 |
0.226 |
7 |
11 |
0 |
1.000 |
16 |
|
J |
53 |
14 |
8490 |
◊ |
G |
-x,y,-z-1/2 |
3_554 |
57 |
12 |
8392 |
514.1 |
-5.8 |
0.275 |
7 |
11 |
0 |
1.000 |
17 |
|
F |
57 |
12 |
8380 |
◊ |
E |
x,y,z |
1_555 |
57 |
14 |
8354 |
512.5 |
-6.1 |
0.245 |
7 |
11 |
0 |
1.000 |
18 |
|
E |
56 |
12 |
8354 |
◊ |
C |
x,y,z |
1_555 |
56 |
14 |
8456 |
512.0 |
-5.9 |
0.264 |
7 |
10 |
0 |
1.000 |
19 |
|
J |
54 |
12 |
8490 |
◊ |
I |
-x,y,-z-1/2 |
3_554 |
53 |
14 |
8521 |
510.7 |
-5.8 |
0.228 |
7 |
11 |
0 |
1.000 |
Average: |
516.7 |
-5.7 |
0.274 |
7 |
11 |
0 |
1.000 |
3 |
20 |
|
C |
49 |
15 |
8456 |
◊ |
B |
x,y,z |
1_555 |
57 |
13 |
8358 |
464.0 |
-4.2 |
0.514 |
5 |
0 |
0 |
0.200 |
21 |
|
L |
57 |
13 |
8514 |
◊ |
B |
x,y,z |
1_555 |
50 |
14 |
8358 |
461.2 |
-4.0 |
0.524 |
5 |
0 |
0 |
0.200 |
22 |
|
K |
51 |
15 |
8517 |
◊ |
J |
x,y,z |
1_555 |
59 |
13 |
8490 |
461.0 |
-4.0 |
0.496 |
5 |
0 |
0 |
0.200 |
23 |
|
L |
49 |
14 |
8514 |
◊ |
G |
x,y,z |
1_555 |
58 |
13 |
8392 |
460.6 |
-4.0 |
0.515 |
5 |
0 |
0 |
0.200 |
24 |
|
I |
58 |
13 |
8521 |
◊ |
F |
x,y,z |
1_555 |
50 |
15 |
8380 |
460.1 |
-4.1 |
0.478 |
5 |
0 |
0 |
0.200 |
25 |
|
H |
49 |
15 |
8489 |
◊ |
D |
-x,y,-z-1/2 |
3_554 |
57 |
13 |
8430 |
458.8 |
-4.1 |
0.488 |
5 |
0 |
0 |
0.200 |
26 |
|
F |
56 |
13 |
8380 |
◊ |
D |
x,y,z |
1_555 |
51 |
14 |
8430 |
458.4 |
-3.9 |
0.514 |
5 |
0 |
0 |
0.200 |
27 |
|
I |
49 |
14 |
8521 |
◊ |
H |
-x,y,-z-1/2 |
3_554 |
56 |
13 |
8489 |
458.0 |
-4.1 |
0.464 |
5 |
0 |
0 |
0.200 |
28 |
|
G |
49 |
15 |
8392 |
◊ |
C |
x,y,z |
1_555 |
57 |
13 |
8456 |
457.9 |
-4.0 |
0.515 |
5 |
0 |
0 |
0.200 |
29 |
|
K |
56 |
13 |
8517 |
◊ |
E |
x,y,z |
1_555 |
51 |
15 |
8354 |
456.9 |
-3.9 |
0.513 |
5 |
0 |
0 |
0.200 |
30 |
|
J |
52 |
15 |
8490 |
◊ |
A |
x,y,z |
1_555 |
56 |
13 |
8508 |
455.1 |
-4.5 |
0.432 |
6 |
0 |
0 |
0.200 |
31 |
|
E |
56 |
13 |
8354 |
◊ |
A |
x,y,z |
1_555 |
49 |
14 |
8508 |
442.3 |
-4.4 |
0.457 |
5 |
0 |
0 |
0.200 |
Average: |
457.9 |
-4.1 |
0.492 |
5 |
0 |
0 |
0.200 |
4 |
32 |
|
E |
20 |
7 |
8354 |
◊ |
J |
x-1/2,-y-1/2,-z |
8_445 |
23 |
8 |
8490 |
226.8 |
2.8 |
0.913 |
5 |
4 |
0 |
0.000 |
5 |
33 |
|
C |
22 |
7 |
8456 |
◊ |
C |
-x-1,y,-z-1/2 |
3_454 |
21 |
7 |
8456 |
221.5 |
0.3 |
0.748 |
2 |
0 |
0 |
0.000 |
6 |
34 |
|
D |
18 |
8 |
8430 |
◊ |
B |
-x-1/2,y-1/2,-z-1/2 |
7_444 |
20 |
8 |
8358 |
189.1 |
1.9 |
0.875 |
2 |
2 |
0 |
0.000 |
7 |
35 |
|
F |
8 |
3 |
8380 |
◊ |
L |
-x-1/2,y-1/2,-z-1/2 |
7_444 |
9 |
3 |
8514 |
99.8 |
1.6 |
0.879 |
0 |
0 |
0 |
0.000 |
8 |
36 |
|
F |
12 |
6 |
8380 |
◊ |
L |
x-1/2,y-1/2,z |
5_445 |
8 |
4 |
8514 |
94.7 |
2.1 |
0.890 |
2 |
1 |
0 |
0.000 |
37 |
|
K |
8 |
4 |
8517 |
◊ |
L |
-x-1/2,y-1/2,-z-1/2 |
7_444 |
13 |
6 |
8514 |
88.0 |
1.4 |
0.849 |
1 |
1 |
0 |
0.000 |
Average: |
91.3 |
1.7 |
0.870 |
2 |
1 |
0 |
0.000 |
9 |
38 |
|
I |
6 |
3 |
8521 |
◊ |
J |
-x-1/2,-y-1/2,z-1/2 |
6_444 |
10 |
4 |
8490 |
87.3 |
0.0 |
0.660 |
0 |
0 |
0 |
0.000 |
10 |
39 |
|
I |
11 |
4 |
8521 |
◊ |
K |
-x-1/2,-y-1/2,z-1/2 |
6_444 |
12 |
4 |
8517 |
80.7 |
0.7 |
0.743 |
0 |
0 |
0 |
0.000 |
11 |
40 |
|
G |
7 |
3 |
8392 |
◊ |
E |
-x-1/2,-y-1/2,z-1/2 |
6_444 |
7 |
2 |
8354 |
76.0 |
0.8 |
0.778 |
1 |
0 |
0 |
0.000 |
12 |
41 |
|
[K]B:201 |
1 |
1 |
216 |
◊ |
L |
x,y,z |
1_555 |
9 |
2 |
8514 |
52.8 |
-26.9 |
0.000 |
0 |
0 |
0 |
0.816 |
42 |
|
[K]A:201 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
7 |
2 |
8508 |
52.7 |
-26.7 |
0.000 |
0 |
0 |
0 |
0.816 |
43 |
|
[K]A:201 |
1 |
1 |
216 |
◊ |
K |
x,y,z |
1_555 |
8 |
2 |
8517 |
52.7 |
-26.5 |
0.000 |
0 |
0 |
0 |
0.816 |
44 |
|
[K]A:201 |
1 |
1 |
216 |
◊ |
E |
x,y,z |
1_555 |
7 |
2 |
8354 |
52.5 |
-26.4 |
0.000 |
0 |
0 |
0 |
0.816 |
45 |
|
[K]B:201 |
1 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
7 |
2 |
8456 |
52.5 |
-26.5 |
0.000 |
0 |
0 |
0 |
0.816 |
46 |
|
[K]D:201 |
1 |
1 |
216 |
◊ |
D |
x,y,z |
1_555 |
7 |
2 |
8430 |
52.5 |
-26.6 |
0.000 |
0 |
0 |
0 |
0.816 |
47 |
|
[K]D:201 |
1 |
1 |
216 |
◊ |
I |
x,y,z |
1_555 |
8 |
2 |
8521 |
52.4 |
-26.6 |
0.000 |
0 |
0 |
0 |
0.816 |
48 |
|
[K]A:201 |
1 |
1 |
216 |
◊ |
J |
x,y,z |
1_555 |
9 |
2 |
8490 |
52.4 |
-26.4 |
0.000 |
0 |
0 |
0 |
0.816 |
49 |
|
[K]D:201 |
1 |
1 |
216 |
◊ |
H |
-x,y,-z-1/2 |
3_554 |
8 |
2 |
8489 |
52.3 |
-26.4 |
0.000 |
0 |
0 |
0 |
0.816 |
50 |
|
[K]B:201 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
7 |
2 |
8358 |
52.3 |
-26.3 |
0.000 |
0 |
0 |
0 |
0.816 |
51 |
|
[K]D:201 |
1 |
1 |
216 |
◊ |
F |
x,y,z |
1_555 |
8 |
2 |
8380 |
52.1 |
-26.4 |
0.000 |
0 |
0 |
0 |
0.816 |
52 |
|
[K]B:201 |
1 |
1 |
216 |
◊ |
G |
x,y,z |
1_555 |
8 |
2 |
8392 |
52.1 |
-26.4 |
0.000 |
0 |
0 |
0 |
0.816 |
Average: |
52.4 |
-26.5 |
0.000 |
0 |
0 |
0 |
0.816 |
13 |
53 |
|
D |
6 |
4 |
8430 |
◊ |
L |
x-1/2,y-1/2,z |
5_445 |
3 |
1 |
8514 |
43.9 |
1.3 |
0.856 |
2 |
0 |
0 |
0.000 |
54 |
|
K |
3 |
1 |
8517 |
◊ |
B |
-x-1/2,y-1/2,-z-1/2 |
7_444 |
6 |
4 |
8358 |
43.4 |
1.4 |
0.870 |
2 |
0 |
0 |
0.000 |
Average: |
43.6 |
1.3 |
0.863 |
2 |
0 |
0 |
0.000 |
14 |
55 |
|
G |
8 |
4 |
8392 |
◊ |
K |
-x-1/2,-y-1/2,z-1/2 |
6_444 |
5 |
3 |
8517 |
31.4 |
0.5 |
0.750 |
0 |
0 |
0 |
0.000 |
15 |
56 |
|
K |
5 |
2 |
8517 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
8508 |
24.1 |
0.6 |
0.826 |
0 |
0 |
0 |
0.000 |
57 |
|
I |
5 |
2 |
8521 |
◊ |
D |
x,y,z |
1_555 |
5 |
2 |
8430 |
23.6 |
0.6 |
0.828 |
0 |
0 |
0 |
0.000 |
58 |
|
G |
5 |
2 |
8392 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
8358 |
23.2 |
0.6 |
0.830 |
0 |
0 |
0 |
0.000 |
59 |
|
H |
5 |
2 |
8489 |
◊ |
F |
-x,y,-z-1/2 |
3_554 |
5 |
2 |
8380 |
22.9 |
0.6 |
0.823 |
0 |
0 |
0 |
0.000 |
60 |
|
L |
5 |
2 |
8514 |
◊ |
C |
x,y,z |
1_555 |
5 |
2 |
8456 |
22.7 |
0.6 |
0.822 |
0 |
0 |
0 |
0.000 |
61 |
|
J |
5 |
2 |
8490 |
◊ |
E |
x,y,z |
1_555 |
5 |
2 |
8354 |
22.4 |
0.6 |
0.822 |
0 |
0 |
0 |
0.000 |
Average: |
23.1 |
0.6 |
0.825 |
0 |
0 |
0 |
0.000 |
16 |
62 |
|
E |
3 |
2 |
8354 |
◊ |
C |
-x-1,y,-z-1/2 |
3_454 |
1 |
1 |
8456 |
14.2 |
0.4 |
0.822 |
0 |
0 |
0 |
0.000 |
17 |
63 |
|
I |
1 |
1 |
8521 |
◊ |
L |
x-1/2,y-1/2,z |
5_445 |
2 |
1 |
8514 |
4.3 |
0.1 |
0.712 |
0 |
0 |
0 |
0.000 |
|