| ## |
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 |
|
F |
94 |
25 |
13352 |
◊ |
F |
x,-y,-z+1 |
4_556 |
94 |
25 |
13352 |
960.9 |
-5.9 |
0.427 |
20 |
0 |
0 |
0.743 |
2 |
|
H |
95 |
24 |
13357 |
◊ |
G |
x,y,z |
1_555 |
100 |
25 |
13449 |
922.4 |
-9.4 |
0.234 |
21 |
0 |
0 |
0.743 |
3 |
|
D |
96 |
24 |
13299 |
◊ |
C |
x,y,z |
1_555 |
102 |
25 |
13467 |
909.2 |
-7.8 |
0.308 |
22 |
0 |
1 |
0.743 |
4 |
|
B |
96 |
24 |
13596 |
◊ |
A |
x,y,z |
1_555 |
95 |
22 |
13621 |
904.3 |
-7.7 |
0.322 |
20 |
0 |
1 |
0.743 |
5 |
|
E |
97 |
23 |
13485 |
◊ |
E |
x,-y+1,-z+1 |
4_566 |
97 |
23 |
13485 |
895.1 |
-5.6 |
0.445 |
28 |
0 |
0 |
0.743 |
| Average: |
918.4 |
-7.3 |
0.347 |
22 |
0 |
0 |
0.743 |
| 2 |
6 |
|
G |
60 |
15 |
13449 |
◊ |
C |
-x+2,y,-z+1/2 |
3_755 |
65 |
21 |
13467 |
587.5 |
-2.2 |
0.548 |
8 |
0 |
0 |
0.000 |
| 3 |
7 |
|
G |
62 |
21 |
13449 |
◊ |
B |
x,y,z |
1_555 |
57 |
14 |
13596 |
566.5 |
-2.4 |
0.455 |
3 |
0 |
0 |
0.000 |
8 |
|
D |
53 |
20 |
13299 |
◊ |
E |
x-1/2,-y+1/2,-z+1 |
8_456 |
50 |
14 |
13485 |
493.1 |
-1.2 |
0.581 |
8 |
1 |
0 |
0.000 |
9 |
|
F |
57 |
21 |
13352 |
◊ |
A |
x,y,z |
1_555 |
46 |
13 |
13621 |
448.5 |
-1.5 |
0.582 |
9 |
0 |
0 |
0.000 |
| Average: |
502.7 |
-1.7 |
0.539 |
7 |
0 |
0 |
0.000 |
| 4 |
10 |
|
F |
52 |
16 |
13352 |
◊ |
D |
x-1/2,-y+1/2,-z+1 |
8_456 |
52 |
16 |
13299 |
521.3 |
-2.3 |
0.542 |
6 |
2 |
0 |
0.000 |
11 |
|
H |
55 |
18 |
13357 |
◊ |
C |
x-1/2,y+1/2,z |
5_455 |
51 |
15 |
13467 |
517.8 |
-0.8 |
0.652 |
6 |
2 |
0 |
0.000 |
| Average: |
519.5 |
-1.6 |
0.597 |
6 |
2 |
0 |
0.000 |
| 5 |
12 |
|
F |
55 |
14 |
13352 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
8_456 |
59 |
19 |
13621 |
503.0 |
-0.0 |
0.722 |
2 |
0 |
0 |
0.000 |
13 |
|
H |
43 |
15 |
13357 |
◊ |
B |
x-1/2,y+1/2,z |
5_455 |
53 |
18 |
13596 |
455.7 |
-2.9 |
0.460 |
3 |
0 |
0 |
0.000 |
| Average: |
479.3 |
-1.5 |
0.591 |
3 |
0 |
0 |
0.000 |
| 6 |
14 |
|
C |
46 |
11 |
13467 |
◊ |
H |
-x+5/2,y-1/2,-z+1/2 |
7_745 |
41 |
15 |
13357 |
414.7 |
-0.4 |
0.662 |
6 |
0 |
0 |
0.000 |
15 |
|
E |
36 |
11 |
13485 |
◊ |
D |
x,y,z |
1_555 |
31 |
8 |
13299 |
322.6 |
-0.9 |
0.578 |
2 |
0 |
0 |
0.000 |
| Average: |
368.7 |
-0.6 |
0.620 |
4 |
0 |
0 |
0.000 |
| 7 |
16 |
|
A |
47 |
15 |
13621 |
◊ |
E |
x-1/2,-y+1/2,-z+1 |
8_456 |
48 |
13 |
13485 |
410.8 |
0.2 |
0.718 |
2 |
1 |
0 |
0.000 |
17 |
|
G |
43 |
13 |
13449 |
◊ |
B |
-x+2,y,-z+1/2 |
3_755 |
46 |
14 |
13596 |
398.0 |
-1.2 |
0.607 |
2 |
0 |
0 |
0.000 |
| Average: |
404.4 |
-0.5 |
0.663 |
2 |
1 |
0 |
0.000 |
| 8 |
18 |
|
H |
40 |
12 |
13357 |
◊ |
H |
-x+2,y,-z+1/2 |
3_755 |
41 |
12 |
13357 |
369.4 |
-4.6 |
0.267 |
7 |
0 |
1 |
0.230 |
19 |
|
G |
38 |
13 |
13449 |
◊ |
G |
-x+2,y,-z+1/2 |
3_755 |
38 |
13 |
13449 |
346.8 |
-3.6 |
0.335 |
7 |
0 |
0 |
0.230 |
20 |
|
F |
38 |
12 |
13352 |
◊ |
E |
x-1/2,-y+1/2,-z+1 |
8_456 |
38 |
12 |
13485 |
345.9 |
-2.7 |
0.426 |
8 |
0 |
0 |
0.230 |
21 |
|
C |
36 |
12 |
13467 |
◊ |
B |
x,y,z |
1_555 |
34 |
11 |
13596 |
313.4 |
-3.0 |
0.371 |
6 |
0 |
1 |
0.230 |
22 |
|
D |
36 |
12 |
13299 |
◊ |
A |
x,y,z |
1_555 |
35 |
13 |
13621 |
304.9 |
-3.2 |
0.362 |
5 |
0 |
1 |
0.230 |
| Average: |
336.1 |
-3.4 |
0.352 |
7 |
0 |
1 |
0.230 |
| 9 |
23 |
|
[CL]C:501 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
8 |
5 |
13467 |
61.8 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.489 |
24 |
|
[CL]F:503 |
1 |
1 |
125 |
f |
F |
x,y,z |
1_555 |
7 |
4 |
13352 |
60.6 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.489 |
25 |
|
[CL]H:504 |
1 |
1 |
125 |
f |
H |
x,y,z |
1_555 |
9 |
5 |
13357 |
56.9 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.489 |
| Average: |
59.8 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.489 |
| 10 |
26 |
|
[CL]A:507 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
13621 |
60.6 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.216 |
27 |
|
[CL]G:505 |
1 |
1 |
125 |
f |
G |
x,y,z |
1_555 |
8 |
3 |
13449 |
48.5 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.216 |
| Average: |
54.5 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.216 |
| 11 |
28 |
|
[CL]E:508 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
9 |
5 |
13485 |
54.9 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.444 |
29 |
|
[CL]A:509 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
13621 |
54.6 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.444 |
30 |
|
[CL]G:502 |
1 |
1 |
125 |
f |
G |
x,y,z |
1_555 |
7 |
4 |
13449 |
53.1 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.444 |
| Average: |
54.2 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.444 |
| 12 |
31 |
|
[CL]G:506 |
1 |
1 |
125 |
f |
G |
x,y,z |
1_555 |
6 |
3 |
13449 |
54.6 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.151 |
| 13 |
32 |
|
[CL]C:501 |
1 |
1 |
125 |
◊ |
H |
-x+5/2,y-1/2,-z+1/2 |
7_745 |
6 |
2 |
13357 |
37.6 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.000 |
33 |
|
[CL]H:504 |
1 |
1 |
125 |
◊ |
B |
x-1/2,y+1/2,z |
5_455 |
4 |
2 |
13596 |
30.8 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.000 |
34 |
|
[CL]F:503 |
1 |
1 |
125 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
8_456 |
3 |
2 |
13621 |
22.7 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.000 |
| Average: |
30.4 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.000 |
| 14 |
35 |
|
[CL]G:505 |
1 |
1 |
125 |
◊ |
C |
-x+2,y,-z+1/2 |
3_755 |
3 |
1 |
13467 |
36.1 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.000 |
36 |
|
[CL]A:507 |
1 |
1 |
125 |
◊ |
F |
x,y,z |
1_555 |
2 |
1 |
13352 |
19.3 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.000 |
| Average: |
27.7 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.000 |
| 15 |
37 |
|
C |
3 |
1 |
13467 |
◊ |
C |
-x+3,y,-z+1/2 |
3_855 |
3 |
1 |
13467 |
19.8 |
0.4 |
0.775 |
0 |
0 |
0 |
0.000 |
|