## |
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 |
218 |
65 |
11451 |
◊ |
C |
x,y,z |
1_555 |
211 |
57 |
12594 |
2012.7 |
-31.8 |
0.058 |
21 |
1 |
1 |
1.000 |
2 |
|
K |
201 |
64 |
11371 |
◊ |
J |
x,y,z |
1_555 |
206 |
56 |
12740 |
1938.1 |
-29.6 |
0.076 |
16 |
1 |
1 |
1.000 |
3 |
|
I |
214 |
65 |
11393 |
◊ |
G |
x,y,z |
1_555 |
206 |
57 |
12588 |
1928.3 |
-31.6 |
0.052 |
18 |
2 |
1 |
1.000 |
4 |
|
L |
202 |
60 |
11518 |
◊ |
H |
x,y,z |
1_555 |
208 |
58 |
12820 |
1897.2 |
-31.3 |
0.050 |
20 |
1 |
1 |
1.000 |
5 |
|
F |
200 |
63 |
11375 |
◊ |
E |
x,y,z |
1_555 |
205 |
59 |
12513 |
1874.2 |
-32.4 |
0.042 |
16 |
0 |
1 |
1.000 |
6 |
|
B |
197 |
60 |
11502 |
◊ |
A |
x,y,z |
1_555 |
202 |
58 |
13739 |
1854.7 |
-33.9 |
0.020 |
17 |
0 |
1 |
1.000 |
Average: |
1917.5 |
-31.8 |
0.050 |
18 |
1 |
1 |
1.000 |
2 |
7 |
|
C |
33 |
11 |
12594 |
◊ |
H |
x-1,y,z-1 |
1_454 |
38 |
13 |
12820 |
324.6 |
-1.3 |
0.640 |
4 |
0 |
0 |
0.000 |
8 |
|
J |
34 |
11 |
12740 |
◊ |
G |
x,y,z |
1_555 |
29 |
13 |
12588 |
289.6 |
-1.1 |
0.711 |
2 |
0 |
0 |
0.000 |
Average: |
307.1 |
-1.2 |
0.676 |
3 |
0 |
0 |
0.000 |
3 |
9 |
|
J |
35 |
11 |
12740 |
◊ |
L |
x-1,y,z |
1_455 |
34 |
12 |
11518 |
319.3 |
0.6 |
0.818 |
7 |
0 |
0 |
0.000 |
4 |
10 |
|
B |
30 |
9 |
11502 |
◊ |
E |
x,y,z-1 |
1_554 |
34 |
11 |
12513 |
301.7 |
-0.4 |
0.752 |
7 |
0 |
0 |
0.000 |
5 |
11 |
|
G |
34 |
12 |
12588 |
◊ |
E |
x,y,z |
1_555 |
31 |
12 |
12513 |
289.3 |
-1.5 |
0.660 |
3 |
0 |
0 |
0.000 |
6 |
12 |
|
C |
35 |
11 |
12594 |
◊ |
A |
x,y,z |
1_555 |
32 |
10 |
13739 |
279.2 |
-1.4 |
0.702 |
5 |
0 |
0 |
0.000 |
13 |
|
H |
27 |
8 |
12820 |
◊ |
A |
x,y,z |
1_555 |
34 |
11 |
13739 |
267.5 |
-2.5 |
0.554 |
3 |
0 |
0 |
0.000 |
14 |
|
J |
32 |
10 |
12740 |
◊ |
E |
x-1,y,z-1 |
1_454 |
26 |
8 |
12513 |
248.8 |
-1.7 |
0.656 |
3 |
0 |
0 |
0.000 |
Average: |
265.2 |
-1.9 |
0.637 |
4 |
0 |
0 |
0.000 |
7 |
15 |
|
A |
32 |
8 |
13739 |
◊ |
L |
-x-1,y-1/2,-z-1 |
2_444 |
29 |
7 |
11518 |
277.3 |
0.2 |
0.723 |
3 |
4 |
0 |
0.000 |
8 |
16 |
|
I |
27 |
9 |
11393 |
◊ |
H |
x,y,z |
1_555 |
25 |
7 |
12820 |
247.6 |
-0.0 |
0.720 |
4 |
0 |
0 |
0.000 |
17 |
|
D |
26 |
10 |
11451 |
◊ |
G |
x,y,z-1 |
1_554 |
25 |
8 |
12588 |
222.8 |
-0.2 |
0.734 |
4 |
0 |
0 |
0.000 |
Average: |
235.2 |
-0.1 |
0.727 |
4 |
0 |
0 |
0.000 |
9 |
18 |
|
J |
26 |
11 |
12740 |
◊ |
H |
-x-2,y-1/2,-z-1 |
2_344 |
25 |
9 |
12820 |
243.3 |
0.5 |
0.839 |
6 |
2 |
0 |
0.000 |
19 |
|
E |
22 |
9 |
12513 |
◊ |
C |
-x-2,y-1/2,-z-1 |
2_344 |
18 |
9 |
12594 |
150.2 |
0.0 |
0.791 |
0 |
0 |
0 |
0.000 |
20 |
|
G |
17 |
7 |
12588 |
◊ |
A |
-x-2,y-1/2,-z-1 |
2_344 |
12 |
6 |
13739 |
127.4 |
-0.6 |
0.658 |
0 |
0 |
0 |
0.000 |
Average: |
173.7 |
-0.0 |
0.763 |
2 |
1 |
0 |
0.000 |
10 |
21 |
|
K |
27 |
10 |
11371 |
◊ |
A |
x,y,z |
1_555 |
25 |
8 |
13739 |
242.3 |
-0.8 |
0.668 |
4 |
0 |
0 |
0.000 |
22 |
|
C |
22 |
7 |
12594 |
◊ |
F |
x-1,y,z-1 |
1_454 |
23 |
9 |
11375 |
222.3 |
-1.4 |
0.583 |
4 |
0 |
0 |
0.000 |
Average: |
232.3 |
-1.1 |
0.625 |
4 |
0 |
0 |
0.000 |
11 |
23 |
|
K |
25 |
9 |
11371 |
◊ |
L |
-x-1,y-1/2,-z-1 |
2_444 |
28 |
11 |
11518 |
235.3 |
-2.5 |
0.375 |
0 |
0 |
0 |
0.000 |
12 |
24 |
|
I |
29 |
11 |
11393 |
◊ |
L |
-x-1,y-1/2,-z-1 |
2_444 |
24 |
10 |
11518 |
231.8 |
-0.8 |
0.561 |
3 |
0 |
0 |
0.000 |
25 |
|
F |
26 |
11 |
11375 |
◊ |
B |
-x-1,y-1/2,-z-1 |
2_444 |
23 |
11 |
11502 |
202.1 |
-0.9 |
0.607 |
2 |
0 |
0 |
0.000 |
Average: |
217.0 |
-0.8 |
0.584 |
3 |
0 |
0 |
0.000 |
13 |
26 |
|
K |
27 |
11 |
11371 |
◊ |
I |
x,y,z |
1_555 |
29 |
9 |
11393 |
218.3 |
-0.3 |
0.681 |
2 |
0 |
0 |
0.000 |
14 |
27 |
|
D |
33 |
13 |
11451 |
◊ |
B |
x,y,z |
1_555 |
18 |
8 |
11502 |
199.4 |
0.9 |
0.734 |
2 |
0 |
0 |
0.000 |
28 |
|
L |
20 |
10 |
11518 |
◊ |
B |
x,y,z |
1_555 |
25 |
11 |
11502 |
175.9 |
0.6 |
0.670 |
2 |
0 |
0 |
0.000 |
29 |
|
K |
21 |
9 |
11371 |
◊ |
F |
x-1,y,z-1 |
1_454 |
18 |
9 |
11375 |
164.1 |
0.7 |
0.751 |
4 |
0 |
0 |
0.000 |
Average: |
179.8 |
0.7 |
0.718 |
3 |
0 |
0 |
0.000 |
15 |
30 |
|
I |
24 |
6 |
11393 |
◊ |
F |
x,y,z |
1_555 |
23 |
6 |
11375 |
198.6 |
-0.4 |
0.647 |
2 |
0 |
0 |
0.000 |
16 |
31 |
|
A |
15 |
3 |
13739 |
◊ |
H |
-x-1,y-1/2,-z-1 |
2_444 |
32 |
11 |
12820 |
195.0 |
-3.5 |
0.305 |
0 |
0 |
0 |
0.000 |
17 |
32 |
|
E |
18 |
7 |
12513 |
◊ |
H |
-x-1,y-1/2,-z |
2_445 |
23 |
7 |
12820 |
189.0 |
-0.3 |
0.743 |
4 |
0 |
0 |
0.000 |
18 |
33 |
|
L |
23 |
6 |
11518 |
◊ |
A |
x,y,z |
1_555 |
20 |
7 |
13739 |
188.4 |
0.4 |
0.770 |
3 |
2 |
0 |
0.000 |
34 |
|
J |
16 |
7 |
12740 |
◊ |
F |
x-1,y,z-1 |
1_454 |
19 |
6 |
11375 |
157.6 |
2.4 |
0.916 |
2 |
1 |
0 |
0.000 |
35 |
|
B |
18 |
7 |
11502 |
◊ |
C |
x,y,z |
1_555 |
12 |
5 |
12594 |
145.0 |
0.4 |
0.747 |
2 |
1 |
0 |
0.000 |
Average: |
163.7 |
1.1 |
0.811 |
2 |
1 |
0 |
0.000 |
19 |
36 |
|
I |
21 |
10 |
11393 |
◊ |
B |
-x-1,y-1/2,-z-1 |
2_444 |
27 |
13 |
11502 |
186.7 |
-1.2 |
0.554 |
2 |
0 |
0 |
0.000 |
20 |
37 |
|
E |
16 |
4 |
12513 |
◊ |
B |
-x-1,y-1/2,-z-1 |
2_444 |
25 |
9 |
11502 |
186.1 |
-0.9 |
0.622 |
3 |
0 |
0 |
0.000 |
38 |
|
I |
22 |
8 |
11393 |
◊ |
A |
-x-1,y-1/2,-z-1 |
2_444 |
13 |
4 |
13739 |
156.1 |
-0.5 |
0.624 |
2 |
2 |
0 |
0.000 |
Average: |
171.1 |
-0.7 |
0.623 |
3 |
1 |
0 |
0.000 |
21 |
39 |
|
H |
24 |
8 |
12820 |
◊ |
B |
-x-1,y-1/2,-z-1 |
2_444 |
19 |
5 |
11502 |
173.4 |
0.8 |
0.829 |
2 |
0 |
0 |
0.000 |
22 |
40 |
|
J |
15 |
3 |
12740 |
◊ |
D |
-x-2,y-1/2,-z-2 |
2_343 |
23 |
8 |
11451 |
168.6 |
-0.7 |
0.639 |
2 |
0 |
0 |
0.000 |
41 |
|
F |
21 |
8 |
11375 |
◊ |
C |
-x-1,y-1/2,-z-1 |
2_444 |
14 |
3 |
12594 |
158.9 |
-1.2 |
0.538 |
3 |
0 |
0 |
0.000 |
Average: |
163.8 |
-1.0 |
0.588 |
3 |
0 |
0 |
0.000 |
23 |
42 |
|
J |
22 |
8 |
12740 |
◊ |
H |
x-1,y,z |
1_455 |
14 |
3 |
12820 |
168.0 |
-1.2 |
0.621 |
2 |
0 |
0 |
0.000 |
24 |
43 |
|
F |
18 |
5 |
11375 |
◊ |
E |
-x-1,y-1/2,-z |
2_445 |
16 |
3 |
12513 |
161.6 |
1.7 |
0.830 |
1 |
3 |
0 |
0.000 |
25 |
44 |
|
I |
16 |
4 |
11393 |
◊ |
J |
-x-2,y-1/2,-z-1 |
2_344 |
19 |
5 |
12740 |
157.5 |
0.7 |
0.668 |
1 |
3 |
0 |
0.000 |
26 |
45 |
|
D |
21 |
6 |
11451 |
◊ |
H |
x-1,y,z-1 |
1_454 |
15 |
5 |
12820 |
156.2 |
0.9 |
0.775 |
1 |
1 |
0 |
0.000 |
27 |
46 |
|
A |
17 |
4 |
13739 |
◊ |
E |
x,y,z-1 |
1_554 |
21 |
8 |
12513 |
155.9 |
-0.6 |
0.663 |
3 |
0 |
0 |
0.000 |
28 |
47 |
|
K |
14 |
5 |
11371 |
◊ |
G |
-x-2,y-1/2,-z-1 |
2_344 |
18 |
6 |
12588 |
129.5 |
-0.2 |
0.700 |
0 |
0 |
0 |
0.000 |
29 |
48 |
|
K |
18 |
7 |
11371 |
◊ |
G |
x,y,z |
1_555 |
17 |
6 |
12588 |
129.5 |
0.6 |
0.799 |
1 |
3 |
0 |
0.000 |
30 |
49 |
|
J |
17 |
6 |
12740 |
◊ |
A |
-x-2,y-1/2,-z-1 |
2_344 |
18 |
7 |
13739 |
126.9 |
1.1 |
0.840 |
2 |
0 |
0 |
0.000 |
50 |
|
G |
14 |
7 |
12588 |
◊ |
C |
-x-2,y-1/2,-z-1 |
2_344 |
14 |
6 |
12594 |
116.5 |
0.6 |
0.704 |
1 |
0 |
0 |
0.000 |
Average: |
121.7 |
0.8 |
0.772 |
2 |
0 |
0 |
0.000 |
31 |
51 |
|
C |
14 |
4 |
12594 |
◊ |
D |
-x-2,y-1/2,-z-2 |
2_343 |
17 |
5 |
11451 |
126.1 |
1.0 |
0.762 |
1 |
0 |
0 |
0.000 |
32 |
52 |
|
F |
13 |
6 |
11375 |
◊ |
D |
-x-1,y-1/2,-z-1 |
2_444 |
14 |
7 |
11451 |
118.4 |
-1.3 |
0.443 |
2 |
0 |
0 |
0.000 |
33 |
53 |
|
G |
9 |
3 |
12588 |
◊ |
L |
-x-1,y-1/2,-z-1 |
2_444 |
13 |
6 |
11518 |
104.4 |
-0.9 |
0.481 |
1 |
0 |
0 |
0.000 |
34 |
54 |
|
K |
11 |
6 |
11371 |
◊ |
D |
-x-2,y-1/2,-z-2 |
2_343 |
10 |
5 |
11451 |
104.4 |
-1.0 |
0.400 |
1 |
0 |
0 |
0.000 |
35 |
55 |
|
J |
12 |
5 |
12740 |
◊ |
G |
-x-2,y-1/2,-z-1 |
2_344 |
14 |
4 |
12588 |
97.9 |
-1.2 |
0.440 |
0 |
0 |
0 |
0.000 |
36 |
56 |
|
I |
13 |
4 |
11393 |
◊ |
E |
x,y,z |
1_555 |
10 |
3 |
12513 |
97.5 |
-0.4 |
0.549 |
1 |
3 |
0 |
0.000 |
37 |
57 |
|
K |
10 |
2 |
11371 |
◊ |
L |
x-1,y,z |
1_455 |
12 |
3 |
11518 |
95.9 |
-0.3 |
0.606 |
2 |
1 |
0 |
0.000 |
38 |
58 |
|
D |
12 |
4 |
11451 |
◊ |
F |
x-1,y,z-1 |
1_454 |
14 |
4 |
11375 |
88.6 |
-1.2 |
0.453 |
0 |
0 |
0 |
0.000 |
39 |
59 |
|
C |
9 |
4 |
12594 |
x |
C |
-x-2,y-1/2,-z-2 |
2_343 |
11 |
4 |
12594 |
85.4 |
-1.2 |
0.442 |
0 |
0 |
0 |
0.000 |
40 |
60 |
|
B |
9 |
3 |
11502 |
◊ |
F |
x,y,z-1 |
1_554 |
9 |
3 |
11375 |
79.4 |
-0.8 |
0.450 |
1 |
0 |
0 |
0.000 |
41 |
61 |
|
[CL]J:301 |
1 |
1 |
125 |
f |
J |
x,y,z |
1_555 |
14 |
7 |
12740 |
78.1 |
-11.5 |
0.000 |
0 |
0 |
0 |
0.220 |
42 |
62 |
|
K |
12 |
4 |
11371 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
11502 |
61.8 |
0.1 |
0.670 |
0 |
0 |
0 |
0.000 |
63 |
|
D |
2 |
1 |
11451 |
◊ |
I |
x,y,z-1 |
1_554 |
2 |
1 |
11393 |
6.6 |
-0.1 |
0.536 |
0 |
0 |
0 |
0.000 |
Average: |
34.2 |
0.0 |
0.603 |
0 |
0 |
0 |
0.000 |
43 |
64 |
|
[CL]B:301 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
9 |
5 |
11451 |
61.0 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.152 |
44 |
65 |
|
L |
6 |
2 |
11518 |
◊ |
I |
x,y,z |
1_555 |
8 |
4 |
11393 |
52.4 |
0.7 |
0.782 |
0 |
0 |
0 |
0.000 |
45 |
66 |
|
H |
9 |
2 |
12820 |
◊ |
A |
-x-1,y-1/2,-z-1 |
2_444 |
8 |
2 |
13739 |
48.7 |
-1.2 |
0.426 |
0 |
0 |
0 |
0.000 |
46 |
67 |
|
C |
4 |
1 |
12594 |
◊ |
E |
x,y,z-1 |
1_554 |
7 |
2 |
12513 |
45.8 |
-0.7 |
0.426 |
0 |
0 |
0 |
0.000 |
68 |
|
G |
4 |
2 |
12588 |
◊ |
H |
x-1,y,z |
1_455 |
4 |
3 |
12820 |
30.6 |
0.2 |
0.739 |
1 |
0 |
0 |
0.000 |
Average: |
38.2 |
-0.2 |
0.583 |
1 |
0 |
0 |
0.000 |
47 |
69 |
|
C |
4 |
2 |
12594 |
◊ |
E |
x-1,y,z-1 |
1_454 |
3 |
1 |
12513 |
41.8 |
0.2 |
0.621 |
0 |
0 |
0 |
0.000 |
70 |
|
J |
3 |
1 |
12740 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
13739 |
38.4 |
-0.2 |
0.511 |
0 |
0 |
0 |
0.000 |
Average: |
40.1 |
-0.0 |
0.566 |
0 |
0 |
0 |
0.000 |
48 |
71 |
|
G |
7 |
2 |
12588 |
x |
J |
-x-2,y-1/2,-z-1 |
2_344 |
7 |
3 |
12740 |
40.9 |
-0.7 |
0.500 |
0 |
0 |
0 |
0.000 |
72 |
|
E |
3 |
2 |
12513 |
x |
E |
-x-1,y-1/2,-z |
2_445 |
1 |
1 |
12513 |
4.1 |
-0.1 |
0.463 |
0 |
0 |
0 |
0.000 |
Average: |
22.5 |
-0.4 |
0.482 |
0 |
0 |
0 |
0.000 |
49 |
73 |
|
[CL]B:301 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
11502 |
37.8 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.000 |
50 |
74 |
|
J |
2 |
1 |
12740 |
◊ |
C |
x,y,z |
1_555 |
2 |
2 |
12594 |
10.6 |
-0.3 |
0.386 |
0 |
0 |
0 |
0.000 |
51 |
75 |
|
H |
1 |
1 |
12820 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
12513 |
6.4 |
-0.2 |
0.310 |
0 |
0 |
0 |
0.000 |
52 |
76 |
|
D |
1 |
1 |
11451 |
◊ |
L |
x-1,y,z-1 |
1_454 |
2 |
2 |
11518 |
2.6 |
0.0 |
0.639 |
0 |
0 |
0 |
0.000 |
53 |
77 |
|
A |
2 |
1 |
13739 |
◊ |
C |
-x-2,y-1/2,-z-2 |
2_343 |
1 |
1 |
12594 |
2.5 |
0.1 |
0.701 |
0 |
0 |
0 |
0.000 |
54 |
78 |
|
H |
1 |
1 |
12820 |
◊ |
G |
x,y,z |
1_555 |
1 |
1 |
12588 |
0.2 |
0.0 |
0.640 |
0 |
0 |
0 |
0.000 |
|