| ## |
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 |
|
B |
115 |
33 |
14610 |
◊ |
A |
x,y,z-1 |
1_554 |
120 |
33 |
14835 |
1097.5 |
-16.4 |
0.118 |
13 |
0 |
0 |
0.463 |
| 2 |
2 |
|
[NAP]A:1372 |
47 |
1 |
898 |
f |
A |
x,y,z |
1_555 |
85 |
35 |
14835 |
638.2 |
-5.6 |
0.483 |
16 |
0 |
0 |
0.521 |
3 |
|
[NAP]B:1372 |
48 |
1 |
902 |
f |
B |
x,y,z |
1_555 |
86 |
35 |
14610 |
625.0 |
-5.2 |
0.479 |
16 |
0 |
0 |
0.521 |
| Average: |
631.6 |
-5.4 |
0.481 |
16 |
0 |
0 |
0.521 |
| 3 |
4 |
|
B |
42 |
13 |
14610 |
◊ |
A |
x,y,z |
1_555 |
42 |
13 |
14835 |
384.0 |
-2.0 |
0.656 |
6 |
2 |
0 |
0.000 |
| 4 |
5 |
|
[X1H]A:2002 |
26 |
1 |
557 |
◊ |
A |
x,y,z |
1_555 |
49 |
12 |
14835 |
301.4 |
0.8 |
0.589 |
2 |
0 |
0 |
0.000 |
6 |
|
[X1H]B:2002 |
24 |
1 |
532 |
◊ |
B |
x,y,z |
1_555 |
43 |
11 |
14610 |
275.2 |
2.2 |
0.538 |
2 |
0 |
0 |
0.000 |
| Average: |
288.3 |
1.5 |
0.563 |
2 |
0 |
0 |
0.000 |
| 5 |
7 |
|
[X1H]A:2001 |
26 |
1 |
550 |
f |
A |
x,y,z |
1_555 |
48 |
14 |
14835 |
296.4 |
0.6 |
0.447 |
1 |
0 |
0 |
0.000 |
8 |
|
[X1H]B:2001 |
26 |
1 |
546 |
f |
B |
x,y,z |
1_555 |
46 |
13 |
14610 |
279.6 |
0.4 |
0.425 |
1 |
0 |
0 |
0.000 |
| Average: |
288.0 |
0.5 |
0.436 |
1 |
0 |
0 |
0.000 |
| 6 |
9 |
|
B |
25 |
10 |
14610 |
◊ |
A |
x-1,y,z-1 |
1_454 |
33 |
12 |
14835 |
267.6 |
-2.1 |
0.285 |
3 |
0 |
0 |
0.000 |
| 7 |
10 |
|
A |
20 |
7 |
14835 |
x |
A |
x-1,y,z |
1_455 |
18 |
8 |
14835 |
195.5 |
-2.7 |
0.307 |
0 |
0 |
0 |
0.000 |
| 8 |
11 |
|
A |
20 |
8 |
14835 |
x |
A |
x-1,y-1,z |
1_445 |
18 |
5 |
14835 |
171.4 |
-2.6 |
0.323 |
1 |
0 |
0 |
0.000 |
| 9 |
12 |
|
B |
19 |
6 |
14610 |
◊ |
A |
x-1,y,z |
1_455 |
21 |
7 |
14835 |
151.9 |
-2.0 |
0.463 |
0 |
0 |
0 |
0.000 |
| 10 |
13 |
|
B |
12 |
3 |
14610 |
◊ |
[X1H]A:2001 |
x,y,z-1 |
1_554 |
22 |
1 |
550 |
129.5 |
0.4 |
0.152 |
0 |
0 |
0 |
0.000 |
14 |
|
[X1H]B:2001 |
22 |
1 |
546 |
◊ |
A |
x,y,z-1 |
1_554 |
10 |
3 |
14835 |
119.4 |
-0.4 |
0.110 |
0 |
0 |
0 |
0.000 |
| Average: |
124.4 |
0.0 |
0.131 |
0 |
0 |
0 |
0.000 |
| 11 |
15 |
|
[EDO]A:1362 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
20 |
9 |
14835 |
116.0 |
4.7 |
0.806 |
2 |
0 |
0 |
0.000 |
| 12 |
16 |
|
[EDO]A:1364 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
21 |
8 |
14835 |
109.7 |
2.1 |
0.424 |
0 |
0 |
0 |
0.000 |
| 13 |
17 |
|
B |
12 |
5 |
14610 |
f |
[X1H]A:2002 |
x-1,y,z-1 |
1_454 |
14 |
1 |
557 |
105.7 |
-1.9 |
0.230 |
0 |
0 |
0 |
0.039 |
| 14 |
18 |
|
[EDO]B:1362 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
26 |
10 |
14610 |
93.2 |
2.0 |
0.453 |
0 |
0 |
0 |
0.000 |
| 15 |
19 |
|
[EDO]A:1363 |
4 |
1 |
187 |
◊ |
A |
x,y,z |
1_555 |
15 |
4 |
14835 |
78.8 |
1.9 |
0.406 |
0 |
0 |
0 |
0.000 |
| 16 |
20 |
|
A |
7 |
4 |
14835 |
◊ |
B |
x,y-1,z+1 |
1_546 |
10 |
4 |
14610 |
61.8 |
-0.9 |
0.409 |
0 |
0 |
0 |
0.000 |
| 17 |
21 |
|
[X1H]A:2001 |
4 |
1 |
550 |
f |
[NAP]A:1372 |
x,y,z |
1_555 |
11 |
1 |
898 |
57.4 |
-1.8 |
0.256 |
1 |
0 |
0 |
0.092 |
22 |
|
[X1H]B:2001 |
4 |
1 |
546 |
f |
[NAP]B:1372 |
x,y,z |
1_555 |
11 |
1 |
902 |
55.2 |
-1.7 |
0.253 |
1 |
0 |
0 |
0.092 |
| Average: |
56.3 |
-1.8 |
0.255 |
1 |
0 |
0 |
0.092 |
| 18 |
23 |
|
[NAP]B:1372 |
9 |
1 |
902 |
f |
[EDO]B:1362 |
x,y,z |
1_555 |
4 |
1 |
184 |
44.6 |
0.5 |
0.643 |
0 |
0 |
0 |
0.000 |
| 19 |
24 |
|
B |
5 |
2 |
14610 |
f |
[EDO]A:1363 |
x-1,y,z-1 |
1_454 |
4 |
1 |
187 |
41.3 |
-0.0 |
0.514 |
0 |
0 |
0 |
0.000 |
| 20 |
25 |
|
A |
6 |
2 |
14835 |
x |
A |
x,y-1,z |
1_545 |
2 |
1 |
14835 |
36.1 |
-0.4 |
0.277 |
0 |
0 |
0 |
0.000 |
| 21 |
26 |
|
B |
1 |
1 |
14610 |
◊ |
A |
x-1,y-1,z |
1_445 |
4 |
1 |
14835 |
34.5 |
-0.9 |
0.123 |
0 |
0 |
0 |
0.000 |
| 22 |
27 |
|
[X1H]B:2001 |
3 |
1 |
546 |
f |
[EDO]B:1362 |
x,y,z |
1_555 |
4 |
1 |
184 |
32.4 |
-0.3 |
0.399 |
1 |
0 |
0 |
0.015 |
| 23 |
28 |
|
A |
2 |
2 |
14835 |
◊ |
[EDO]A:1363 |
x-1,y,z |
1_455 |
2 |
1 |
187 |
23.6 |
-0.0 |
0.441 |
0 |
0 |
0 |
0.000 |
| 24 |
29 |
|
[NAP]B:1372 |
3 |
1 |
902 |
◊ |
A |
x,y,z-1 |
1_554 |
3 |
1 |
14835 |
23.0 |
-0.1 |
0.384 |
0 |
0 |
0 |
0.003 |
30 |
|
B |
3 |
1 |
14610 |
◊ |
[NAP]A:1372 |
x,y,z-1 |
1_554 |
2 |
1 |
898 |
20.5 |
-0.0 |
0.429 |
0 |
0 |
0 |
0.003 |
| Average: |
21.8 |
-0.1 |
0.406 |
0 |
0 |
0 |
0.003 |
| 25 |
31 |
|
A |
1 |
1 |
14835 |
◊ |
[X1H]A:2002 |
x-1,y,z |
1_455 |
1 |
1 |
557 |
4.1 |
-0.2 |
0.342 |
0 |
0 |
0 |
0.003 |
| 26 |
32 |
|
[EDO]A:1364 |
1 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
14610 |
2.3 |
0.1 |
0.867 |
0 |
0 |
0 |
0.000 |
|