## |
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 |
95 |
28 |
9579 |
◊ |
B |
x,y,z |
1_555 |
88 |
23 |
10023 |
822.8 |
-2.1 |
0.518 |
18 |
0 |
0 |
0.000 |
2 |
|
C |
93 |
26 |
9415 |
◊ |
A |
x,y,z |
1_555 |
86 |
25 |
10064 |
812.2 |
-2.6 |
0.506 |
15 |
0 |
0 |
0.000 |
Average: |
817.5 |
-2.4 |
0.512 |
17 |
0 |
0 |
0.000 |
2 |
3 |
|
C |
62 |
23 |
9415 |
◊ |
A |
x-1/2,-y-1/2,-z+1 |
4_446 |
71 |
23 |
10064 |
577.3 |
-0.2 |
0.651 |
12 |
0 |
0 |
0.089 |
4 |
|
D |
51 |
18 |
9579 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
60 |
21 |
10023 |
476.6 |
-0.3 |
0.618 |
7 |
0 |
0 |
0.089 |
Average: |
527.0 |
-0.2 |
0.635 |
10 |
0 |
0 |
0.089 |
3 |
5 |
|
C |
64 |
21 |
9415 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
59 |
16 |
10023 |
536.7 |
0.4 |
0.564 |
10 |
2 |
0 |
0.043 |
4 |
6 |
|
D |
53 |
18 |
9579 |
◊ |
A |
x-1/2,-y-1/2,-z+1 |
4_446 |
56 |
15 |
10064 |
500.7 |
-1.2 |
0.393 |
9 |
0 |
0 |
0.052 |
5 |
7 |
|
A |
27 |
11 |
10064 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
23 |
7 |
10023 |
229.7 |
1.5 |
0.777 |
1 |
0 |
0 |
0.000 |
6 |
8 |
|
B |
32 |
8 |
10023 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
21 |
6 |
10064 |
214.2 |
-0.2 |
0.580 |
1 |
0 |
0 |
0.006 |
7 |
9 |
|
B |
20 |
7 |
10023 |
◊ |
A |
x-1/2,-y-1/2,-z+1 |
4_446 |
26 |
8 |
10064 |
210.7 |
1.2 |
0.757 |
4 |
0 |
0 |
0.000 |
8 |
10 |
|
D |
24 |
7 |
9579 |
◊ |
C |
x,y,z |
1_555 |
23 |
7 |
9415 |
203.3 |
-0.7 |
0.441 |
2 |
0 |
0 |
0.016 |
9 |
11 |
|
B |
22 |
7 |
10023 |
◊ |
A |
x,y,z |
1_555 |
22 |
7 |
10064 |
191.9 |
-3.0 |
0.180 |
0 |
0 |
0 |
0.000 |
10 |
12 |
|
[NDG]A:1244 |
15 |
1 |
370 |
f |
A |
x,y,z |
1_555 |
32 |
10 |
10064 |
190.0 |
4.3 |
0.455 |
6 |
0 |
0 |
0.000 |
13 |
|
[NDG]C:1237 |
15 |
1 |
366 |
f |
C |
x,y,z |
1_555 |
30 |
9 |
9415 |
183.5 |
3.7 |
0.349 |
5 |
0 |
0 |
0.000 |
14 |
|
[NDG]B:1244 |
15 |
1 |
367 |
f |
B |
x,y,z |
1_555 |
29 |
9 |
10023 |
182.9 |
4.0 |
0.409 |
6 |
0 |
0 |
0.000 |
Average: |
185.4 |
4.0 |
0.404 |
6 |
0 |
0 |
0.000 |
11 |
15 |
|
[NDG]D:1237 |
15 |
1 |
372 |
f |
D |
x,y,z |
1_555 |
31 |
9 |
9579 |
187.0 |
3.9 |
0.369 |
5 |
0 |
0 |
0.000 |
12 |
16 |
|
[NAG]B:1243 |
15 |
1 |
369 |
f |
B |
x,y,z |
1_555 |
28 |
9 |
10023 |
174.0 |
3.5 |
0.472 |
5 |
0 |
0 |
0.000 |
17 |
|
[NAG]C:1236 |
15 |
1 |
372 |
f |
C |
x,y,z |
1_555 |
29 |
9 |
9415 |
170.8 |
3.2 |
0.430 |
5 |
0 |
0 |
0.000 |
18 |
|
[NAG]D:1236 |
15 |
1 |
371 |
f |
D |
x,y,z |
1_555 |
30 |
9 |
9579 |
170.6 |
3.1 |
0.419 |
5 |
0 |
0 |
0.000 |
19 |
|
[NAG]A:1243 |
15 |
1 |
370 |
f |
A |
x,y,z |
1_555 |
33 |
10 |
10064 |
170.6 |
3.4 |
0.491 |
6 |
0 |
0 |
0.000 |
Average: |
171.5 |
3.3 |
0.453 |
5 |
0 |
0 |
0.000 |
13 |
20 |
|
[CIT]B:1245 |
13 |
1 |
308 |
f |
B |
x,y,z |
1_555 |
16 |
8 |
10023 |
145.6 |
-0.2 |
0.277 |
2 |
0 |
0 |
0.015 |
14 |
21 |
|
[NDG]D:1237 |
14 |
1 |
372 |
f |
[NAG]D:1236 |
x,y,z |
1_555 |
15 |
1 |
371 |
136.0 |
5.4 |
0.136 |
0 |
0 |
0 |
0.000 |
22 |
|
[NDG]C:1237 |
14 |
1 |
366 |
f |
[NAG]C:1236 |
x,y,z |
1_555 |
15 |
1 |
372 |
135.0 |
5.3 |
0.132 |
0 |
0 |
0 |
0.000 |
23 |
|
[NDG]B:1244 |
15 |
1 |
367 |
f |
[NAG]B:1243 |
x,y,z |
1_555 |
14 |
1 |
369 |
131.5 |
5.1 |
0.136 |
0 |
0 |
0 |
0.000 |
24 |
|
[NDG]A:1244 |
15 |
1 |
370 |
f |
[NAG]A:1243 |
x,y,z |
1_555 |
15 |
1 |
370 |
124.5 |
4.9 |
0.115 |
0 |
0 |
0 |
0.000 |
Average: |
131.7 |
5.2 |
0.130 |
0 |
0 |
0 |
0.000 |
15 |
25 |
|
[PEG]B:1247 |
7 |
1 |
259 |
◊ |
B |
x,y,z |
1_555 |
21 |
8 |
10023 |
127.4 |
3.6 |
0.405 |
0 |
0 |
0 |
0.000 |
16 |
26 |
|
[PEG]A:1245 |
7 |
1 |
253 |
◊ |
A |
x,y,z |
1_555 |
16 |
7 |
10064 |
118.0 |
3.4 |
0.368 |
1 |
0 |
0 |
0.000 |
17 |
27 |
|
[GOL]C:1238 |
6 |
1 |
219 |
f |
C |
x,y,z |
1_555 |
19 |
8 |
9415 |
116.7 |
-0.6 |
0.518 |
6 |
0 |
0 |
0.032 |
18 |
28 |
|
[GOL]D:1238 |
6 |
1 |
214 |
f |
D |
x,y,z |
1_555 |
17 |
7 |
9579 |
114.5 |
-1.0 |
0.486 |
6 |
0 |
0 |
0.036 |
19 |
29 |
|
[PEG]D:1239 |
7 |
1 |
256 |
f |
D |
x,y,z |
1_555 |
13 |
7 |
9579 |
113.9 |
1.7 |
0.254 |
3 |
0 |
0 |
0.000 |
20 |
30 |
|
[PEG]D:1239 |
6 |
1 |
256 |
◊ |
B |
x,y,z |
1_555 |
10 |
5 |
10023 |
89.6 |
2.9 |
0.366 |
0 |
0 |
0 |
0.000 |
21 |
31 |
|
D |
10 |
4 |
9579 |
f |
[PEG]B:1247 |
-x,y-1/2,-z+1/2 |
3_545 |
7 |
1 |
259 |
87.6 |
1.4 |
0.199 |
1 |
0 |
0 |
0.000 |
22 |
32 |
|
C |
9 |
5 |
9415 |
◊ |
[GOL]B:1246 |
-x,y-1/2,-z+1/2 |
3_545 |
5 |
1 |
217 |
74.6 |
-0.0 |
0.479 |
1 |
0 |
0 |
0.005 |
23 |
33 |
|
C |
11 |
2 |
9415 |
◊ |
[CIT]B:1245 |
-x,y-1/2,-z+1/2 |
3_545 |
7 |
1 |
308 |
60.5 |
0.9 |
0.403 |
0 |
0 |
0 |
0.000 |
24 |
34 |
|
A |
5 |
2 |
10064 |
◊ |
[CIT]B:1245 |
-x,y-1/2,-z+1/2 |
3_545 |
7 |
1 |
308 |
59.3 |
-0.2 |
0.166 |
0 |
0 |
0 |
0.000 |
25 |
35 |
|
[NA]A:1246 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
10064 |
59.0 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.068 |
26 |
36 |
|
D |
7 |
2 |
9579 |
◊ |
C |
-x-1/2,-y-1,z-1/2 |
2_444 |
8 |
2 |
9415 |
58.6 |
0.8 |
0.773 |
0 |
0 |
0 |
0.000 |
27 |
37 |
|
[GOL]B:1246 |
5 |
1 |
217 |
f |
B |
x,y,z |
1_555 |
6 |
3 |
10023 |
57.0 |
-0.5 |
0.398 |
1 |
0 |
0 |
0.014 |
28 |
38 |
|
[NA]C:1240 |
1 |
1 |
125 |
f |
A |
x-1/2,-y-1/2,-z+1 |
4_446 |
15 |
5 |
10064 |
54.2 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.068 |
29 |
39 |
|
[NA]C:1240 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
6 |
3 |
9415 |
49.1 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.061 |
30 |
40 |
|
[NA]C:1239 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
11 |
4 |
9415 |
47.2 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.155 |
41 |
|
[NA]D:1241 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
9 |
4 |
9579 |
41.0 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.155 |
42 |
|
[NA]D:1240 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
7 |
3 |
9579 |
29.8 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.155 |
Average: |
39.4 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.155 |
31 |
43 |
|
[NA]D:1240 |
1 |
1 |
125 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
8 |
4 |
10023 |
47.0 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.063 |
32 |
44 |
|
C |
4 |
2 |
9415 |
f |
[PEG]A:1245 |
x-1/2,-y-1/2,-z+1 |
4_446 |
3 |
1 |
253 |
46.1 |
1.1 |
0.293 |
1 |
0 |
0 |
0.000 |
33 |
45 |
|
[NA]A:1246 |
1 |
1 |
125 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
9 |
3 |
10023 |
41.5 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.000 |
34 |
46 |
|
[NA]C:1239 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
4 |
4 |
9579 |
24.1 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.064 |
47 |
|
[NA]D:1241 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
4 |
4 |
9415 |
22.9 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.064 |
48 |
|
[NA]D:1240 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
2 |
2 |
9415 |
5.9 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.064 |
Average: |
17.6 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.064 |
35 |
49 |
|
[CA]D:1235 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
8 |
4 |
9579 |
23.1 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.249 |
50 |
|
[CA]B:1242 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
10023 |
23.0 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.249 |
51 |
|
[CA]C:1235 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
8 |
4 |
9415 |
22.7 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.249 |
52 |
|
[CA]A:1242 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
6 |
4 |
10064 |
22.7 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.249 |
Average: |
22.9 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.249 |
36 |
53 |
|
[NA]C:1239 |
1 |
1 |
125 |
◊ |
A |
x-1/2,-y-1/2,-z+1 |
4_446 |
5 |
3 |
10064 |
22.0 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.046 |
54 |
|
[NA]D:1241 |
1 |
1 |
125 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
4 |
2 |
10023 |
17.8 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.046 |
Average: |
19.9 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.046 |
37 |
55 |
|
[NA]D:1241 |
1 |
1 |
125 |
f |
[NA]D:1240 |
x,y,z |
1_555 |
1 |
1 |
125 |
21.8 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.043 |
38 |
56 |
|
[NDG]D:1237 |
4 |
1 |
372 |
f |
[CA]D:1235 |
x,y,z |
1_555 |
1 |
1 |
85 |
20.9 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.133 |
57 |
|
[NDG]C:1237 |
4 |
1 |
366 |
f |
[CA]C:1235 |
x,y,z |
1_555 |
1 |
1 |
85 |
20.6 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.133 |
58 |
|
[NDG]A:1244 |
4 |
1 |
370 |
f |
[CA]A:1242 |
x,y,z |
1_555 |
1 |
1 |
85 |
20.4 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.133 |
59 |
|
[NDG]B:1244 |
4 |
1 |
367 |
f |
[CA]B:1242 |
x,y,z |
1_555 |
1 |
1 |
85 |
20.1 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.133 |
Average: |
20.5 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.133 |
39 |
60 |
|
[NAG]A:1243 |
3 |
1 |
370 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
7 |
3 |
10023 |
20.0 |
0.3 |
0.387 |
0 |
0 |
0 |
0.000 |
40 |
61 |
|
[NAG]D:1236 |
4 |
1 |
371 |
f |
[CA]D:1235 |
x,y,z |
1_555 |
1 |
1 |
85 |
19.5 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.131 |
62 |
|
[NAG]B:1243 |
4 |
1 |
369 |
f |
[CA]B:1242 |
x,y,z |
1_555 |
1 |
1 |
85 |
19.5 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.131 |
63 |
|
[NAG]C:1236 |
3 |
1 |
372 |
f |
[CA]C:1235 |
x,y,z |
1_555 |
1 |
1 |
85 |
19.5 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.131 |
64 |
|
[NAG]A:1243 |
4 |
1 |
370 |
f |
[CA]A:1242 |
x,y,z |
1_555 |
1 |
1 |
85 |
18.9 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.131 |
Average: |
19.3 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.131 |
41 |
65 |
|
[NDG]A:1244 |
4 |
1 |
370 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
4 |
3 |
10023 |
11.6 |
0.2 |
0.281 |
0 |
0 |
0 |
0.000 |
42 |
66 |
|
[NA]C:1239 |
1 |
1 |
125 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
2 |
2 |
10023 |
11.5 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.017 |
67 |
|
[NA]D:1241 |
1 |
1 |
125 |
◊ |
A |
x-1/2,-y-1/2,-z+1 |
4_446 |
3 |
2 |
10064 |
11.2 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.017 |
Average: |
11.3 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.017 |
43 |
68 |
|
[NA]A:1246 |
1 |
1 |
125 |
◊ |
[CIT]B:1245 |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
308 |
7.3 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.000 |
44 |
69 |
|
[NA]D:1240 |
1 |
1 |
125 |
◊ |
A |
x-1/2,-y-1/2,-z+1 |
4_446 |
2 |
1 |
10064 |
3.3 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.003 |
45 |
70 |
|
[NAG]B:1243 |
1 |
1 |
369 |
◊ |
A |
x-1/2,-y-1/2,-z+1 |
4_446 |
1 |
1 |
10064 |
0.8 |
-0.0 |
0.257 |
0 |
0 |
0 |
0.000 |
46 |
71 |
|
[NDG]B:1244 |
1 |
1 |
367 |
◊ |
A |
x-1/2,-y-1/2,-z+1 |
4_446 |
1 |
1 |
10064 |
0.4 |
-0.0 |
0.187 |
0 |
0 |
0 |
0.000 |
|