## |
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 |
|
E |
244 |
58 |
8213 |
◊ |
D |
x,y,z |
1_555 |
238 |
57 |
7319 |
2268.6 |
-27.2 |
0.298 |
43 |
2 |
0 |
1.000 |
2 |
|
B |
239 |
56 |
8420 |
◊ |
A |
x,y,z |
1_555 |
231 |
58 |
7235 |
2234.6 |
-24.6 |
0.341 |
45 |
3 |
0 |
1.000 |
3 |
|
H |
237 |
55 |
8314 |
◊ |
G |
x,y,z |
1_555 |
224 |
54 |
7106 |
2195.2 |
-26.4 |
0.269 |
43 |
1 |
0 |
1.000 |
Average: |
2232.8 |
-26.1 |
0.303 |
44 |
2 |
0 |
1.000 |
2 |
4 |
|
X |
122 |
40 |
13995 |
◊ |
A |
x,y,z |
1_555 |
90 |
26 |
7235 |
1030.7 |
-7.5 |
0.494 |
16 |
4 |
0 |
1.000 |
5 |
|
Y |
122 |
36 |
13547 |
◊ |
D |
x,y,z |
1_555 |
86 |
24 |
7319 |
976.7 |
-3.0 |
0.643 |
14 |
5 |
0 |
1.000 |
6 |
|
Z |
116 |
37 |
14142 |
◊ |
G |
x,y,z |
1_555 |
86 |
24 |
7106 |
937.7 |
-4.2 |
0.660 |
12 |
7 |
0 |
1.000 |
Average: |
981.7 |
-4.9 |
0.599 |
14 |
5 |
0 |
1.000 |
3 |
7 |
|
Z |
102 |
35 |
14142 |
◊ |
H |
x,y,z |
1_555 |
92 |
23 |
8314 |
863.6 |
0.7 |
0.674 |
15 |
7 |
0 |
0.147 |
8 |
|
X |
91 |
34 |
13995 |
◊ |
B |
x,y,z |
1_555 |
81 |
22 |
8420 |
808.2 |
2.1 |
0.791 |
11 |
8 |
0 |
0.147 |
9 |
|
Y |
92 |
34 |
13547 |
◊ |
E |
x,y,z |
1_555 |
88 |
23 |
8213 |
795.2 |
-0.5 |
0.598 |
11 |
7 |
0 |
0.147 |
Average: |
822.4 |
0.8 |
0.688 |
12 |
7 |
0 |
0.147 |
4 |
10 |
|
Z |
23 |
9 |
14142 |
◊ |
Y |
x,y,z |
1_555 |
30 |
9 |
13547 |
263.7 |
2.0 |
0.799 |
1 |
0 |
0 |
0.000 |
11 |
|
Y |
30 |
10 |
13547 |
◊ |
X |
x,y,z |
1_555 |
31 |
10 |
13995 |
258.7 |
0.4 |
0.644 |
2 |
0 |
0 |
0.000 |
12 |
|
Z |
33 |
10 |
14142 |
◊ |
X |
x,y,z |
1_555 |
27 |
9 |
13995 |
242.8 |
0.5 |
0.596 |
2 |
0 |
0 |
0.000 |
Average: |
255.0 |
0.9 |
0.680 |
2 |
0 |
0 |
0.000 |
5 |
13 |
|
Y |
25 |
7 |
13547 |
◊ |
H |
x,y,z |
1_555 |
30 |
9 |
8314 |
256.8 |
-0.7 |
0.567 |
2 |
2 |
0 |
0.000 |
14 |
|
X |
25 |
7 |
13995 |
◊ |
E |
x,y,z |
1_555 |
27 |
9 |
8213 |
233.7 |
-1.6 |
0.476 |
2 |
0 |
0 |
0.000 |
15 |
|
Z |
21 |
7 |
14142 |
◊ |
B |
x,y,z |
1_555 |
27 |
9 |
8420 |
223.3 |
-1.4 |
0.478 |
2 |
1 |
0 |
0.000 |
Average: |
237.9 |
-1.3 |
0.507 |
2 |
1 |
0 |
0.000 |
6 |
16 |
|
A |
25 |
9 |
7235 |
◊ |
Y |
x,y-1,z |
1_545 |
26 |
7 |
13547 |
226.2 |
-3.2 |
0.283 |
0 |
0 |
0 |
0.000 |
17 |
|
X |
25 |
6 |
13995 |
◊ |
G |
x-1,y-1,z |
1_445 |
21 |
8 |
7106 |
215.9 |
-3.3 |
0.282 |
0 |
0 |
0 |
0.000 |
18 |
|
D |
21 |
9 |
7319 |
◊ |
Z |
x-1,y,z |
1_455 |
23 |
7 |
14142 |
206.6 |
-3.3 |
0.265 |
0 |
0 |
0 |
0.000 |
Average: |
216.2 |
-3.3 |
0.276 |
0 |
0 |
0 |
0.000 |
7 |
19 |
|
[NAG]A:202 |
13 |
1 |
362 |
cf |
A |
x,y,z |
1_555 |
19 |
10 |
7235 |
172.1 |
4.1 |
0.459 |
1 |
0 |
0 |
0.000 |
20 |
|
[NAG]G:202 |
13 |
1 |
363 |
cf |
G |
x,y,z |
1_555 |
18 |
9 |
7106 |
171.3 |
3.8 |
0.438 |
1 |
0 |
0 |
0.000 |
21 |
|
[NAG]D:202 |
13 |
1 |
362 |
cf |
D |
x,y,z |
1_555 |
18 |
9 |
7319 |
170.9 |
4.0 |
0.436 |
1 |
0 |
0 |
0.000 |
Average: |
171.5 |
4.0 |
0.444 |
1 |
0 |
0 |
0.000 |
8 |
22 |
|
[NAG]Z:402 |
11 |
1 |
362 |
cf |
Z |
x,y,z |
1_555 |
17 |
7 |
14142 |
144.0 |
3.2 |
0.373 |
2 |
0 |
0 |
0.000 |
9 |
23 |
|
[NAG]Y:402 |
11 |
1 |
362 |
cf |
Y |
x,y,z |
1_555 |
14 |
7 |
13547 |
143.6 |
3.4 |
0.387 |
2 |
0 |
0 |
0.000 |
24 |
|
[NAG]X:403 |
11 |
1 |
364 |
cf |
X |
x,y,z |
1_555 |
16 |
7 |
13995 |
138.6 |
3.4 |
0.401 |
1 |
0 |
0 |
0.000 |
Average: |
141.1 |
3.4 |
0.394 |
2 |
0 |
0 |
0.000 |
10 |
25 |
|
Z |
21 |
4 |
14142 |
◊ |
B |
-y,x-y,z+1/3 |
2_555 |
14 |
4 |
8420 |
136.0 |
-0.3 |
0.594 |
2 |
0 |
0 |
0.000 |
11 |
26 |
|
[JEF]Z:401 |
8 |
1 |
283 |
f |
Z |
x,y,z |
1_555 |
21 |
7 |
14142 |
132.2 |
-0.2 |
0.519 |
0 |
0 |
0 |
0.010 |
12 |
27 |
|
X |
16 |
5 |
13995 |
◊ |
E |
-y,x-y,z+1/3 |
2_555 |
12 |
3 |
8213 |
113.9 |
-0.5 |
0.512 |
0 |
0 |
0 |
0.000 |
13 |
28 |
|
Y |
10 |
4 |
13547 |
◊ |
Z |
-y,x-y,z+1/3 |
2_555 |
16 |
6 |
14142 |
100.4 |
-0.5 |
0.486 |
0 |
0 |
0 |
0.000 |
14 |
29 |
|
[NAG]E:201 |
10 |
1 |
357 |
cf |
E |
x,y,z |
1_555 |
12 |
4 |
8213 |
95.9 |
2.0 |
0.281 |
0 |
0 |
0 |
0.000 |
15 |
30 |
|
[EDO]X:401 |
4 |
1 |
186 |
◊ |
X |
x,y,z |
1_555 |
12 |
8 |
13995 |
94.4 |
3.1 |
0.516 |
3 |
0 |
0 |
0.000 |
16 |
31 |
|
[NAG]B:201 |
9 |
1 |
359 |
cf |
B |
x,y,z |
1_555 |
10 |
4 |
8420 |
90.7 |
2.6 |
0.366 |
0 |
0 |
0 |
0.000 |
17 |
32 |
|
[NAG]E:202 |
8 |
1 |
365 |
cf |
E |
x,y,z |
1_555 |
12 |
5 |
8213 |
89.6 |
2.9 |
0.474 |
0 |
0 |
0 |
0.000 |
18 |
33 |
|
[EDO]Y:401 |
4 |
1 |
185 |
f |
Y |
x,y,z |
1_555 |
16 |
7 |
13547 |
89.0 |
3.0 |
0.307 |
0 |
0 |
0 |
0.000 |
19 |
34 |
|
[NAG]A:201 |
9 |
1 |
358 |
◊ |
B |
x,y,z |
1_555 |
14 |
3 |
8420 |
88.6 |
1.5 |
0.287 |
1 |
0 |
0 |
0.000 |
20 |
35 |
|
[EDO]X:402 |
4 |
1 |
185 |
f |
X |
x,y,z |
1_555 |
14 |
7 |
13995 |
88.3 |
2.5 |
0.293 |
0 |
0 |
0 |
0.000 |
21 |
36 |
|
[NAG]D:201 |
9 |
1 |
360 |
◊ |
E |
x,y,z |
1_555 |
14 |
4 |
8213 |
88.1 |
1.5 |
0.295 |
1 |
0 |
0 |
0.000 |
37 |
|
[NAG]G:201 |
9 |
1 |
359 |
◊ |
H |
x,y,z |
1_555 |
12 |
3 |
8314 |
82.4 |
1.4 |
0.268 |
0 |
0 |
0 |
0.000 |
Average: |
85.3 |
1.5 |
0.281 |
1 |
0 |
0 |
0.000 |
22 |
38 |
|
[NAG]H:202 |
8 |
1 |
361 |
cf |
H |
x,y,z |
1_555 |
11 |
5 |
8314 |
86.9 |
3.1 |
0.453 |
0 |
0 |
0 |
0.000 |
23 |
39 |
|
[NAG]D:202 |
6 |
1 |
362 |
◊ |
Z |
x-1,y,z |
1_455 |
12 |
3 |
14142 |
83.3 |
0.9 |
0.319 |
0 |
0 |
0 |
0.000 |
40 |
|
X |
12 |
4 |
13995 |
◊ |
[NAG]G:202 |
x-1,y-1,z |
1_445 |
6 |
1 |
363 |
80.3 |
0.9 |
0.328 |
0 |
0 |
0 |
0.000 |
41 |
|
[NAG]A:202 |
6 |
1 |
362 |
◊ |
Y |
x,y-1,z |
1_545 |
12 |
4 |
13547 |
79.4 |
0.8 |
0.323 |
0 |
0 |
0 |
0.000 |
Average: |
81.0 |
0.9 |
0.323 |
0 |
0 |
0 |
0.000 |
24 |
42 |
|
[NAG]B:202 |
9 |
1 |
360 |
cf |
B |
x,y,z |
1_555 |
8 |
4 |
8420 |
80.3 |
1.8 |
0.318 |
0 |
0 |
0 |
0.000 |
25 |
43 |
|
X |
11 |
5 |
13995 |
◊ |
H |
-y,x-y,z+1/3 |
2_555 |
8 |
2 |
8314 |
80.3 |
-1.8 |
0.235 |
0 |
0 |
0 |
0.000 |
26 |
44 |
|
[NAG]D:201 |
8 |
1 |
360 |
cf |
D |
x,y,z |
1_555 |
8 |
4 |
7319 |
78.0 |
2.3 |
0.328 |
2 |
0 |
0 |
0.000 |
27 |
45 |
|
[NAG]G:201 |
9 |
1 |
359 |
cf |
G |
x,y,z |
1_555 |
9 |
4 |
7106 |
77.8 |
2.2 |
0.273 |
2 |
0 |
0 |
0.000 |
46 |
|
[NAG]A:201 |
8 |
1 |
358 |
cf |
A |
x,y,z |
1_555 |
7 |
4 |
7235 |
71.9 |
2.5 |
0.324 |
2 |
0 |
0 |
0.000 |
Average: |
74.8 |
2.4 |
0.298 |
2 |
0 |
0 |
0.000 |
28 |
47 |
|
[NAG]H:201 |
9 |
1 |
361 |
cf |
H |
x,y,z |
1_555 |
10 |
5 |
8314 |
77.2 |
2.4 |
0.328 |
0 |
0 |
0 |
0.000 |
29 |
48 |
|
[EDO]B:203 |
4 |
1 |
187 |
◊ |
B |
x,y,z |
1_555 |
13 |
6 |
8420 |
69.4 |
1.9 |
0.845 |
0 |
0 |
0 |
0.000 |
30 |
49 |
|
Z |
8 |
2 |
14142 |
f |
[EDO]B:203 |
-y,x-y,z+1/3 |
2_555 |
4 |
1 |
187 |
49.2 |
1.5 |
0.791 |
0 |
0 |
0 |
0.000 |
31 |
50 |
|
[NAG]G:201 |
6 |
1 |
359 |
◊ |
Y |
x,y,z |
1_555 |
7 |
2 |
13547 |
47.6 |
1.2 |
0.267 |
2 |
0 |
0 |
0.000 |
51 |
|
[NAG]D:201 |
4 |
1 |
360 |
◊ |
X |
x,y,z |
1_555 |
4 |
2 |
13995 |
39.1 |
1.1 |
0.350 |
2 |
0 |
0 |
0.000 |
Average: |
43.4 |
1.2 |
0.308 |
2 |
0 |
0 |
0.000 |
32 |
52 |
|
[EDO]B:204 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
3 |
2 |
8420 |
44.7 |
1.3 |
0.938 |
1 |
0 |
0 |
0.000 |
33 |
53 |
|
[NAG]A:201 |
5 |
1 |
358 |
◊ |
Z |
x,y,z |
1_555 |
7 |
2 |
14142 |
41.3 |
0.8 |
0.263 |
2 |
0 |
0 |
0.000 |
34 |
54 |
|
[NAG]A:202 |
8 |
1 |
362 |
◊ |
D |
x,y-1,z |
1_545 |
3 |
2 |
7319 |
38.3 |
2.1 |
0.273 |
0 |
0 |
0 |
0.000 |
55 |
|
[NAG]D:202 |
4 |
1 |
362 |
◊ |
G |
x-1,y,z |
1_455 |
2 |
1 |
7106 |
16.7 |
0.9 |
0.416 |
0 |
0 |
0 |
0.000 |
56 |
|
A |
2 |
2 |
7235 |
◊ |
[NAG]G:202 |
x-1,y-1,z |
1_445 |
4 |
1 |
363 |
12.6 |
0.7 |
0.378 |
0 |
0 |
0 |
0.000 |
Average: |
22.5 |
1.3 |
0.356 |
0 |
0 |
0 |
0.000 |
35 |
57 |
|
X |
9 |
4 |
13995 |
◊ |
B |
-y,x-y,z+1/3 |
2_555 |
3 |
2 |
8420 |
37.8 |
0.3 |
0.599 |
0 |
0 |
0 |
0.000 |
36 |
58 |
|
D |
4 |
2 |
7319 |
◊ |
G |
x-1,y,z |
1_455 |
2 |
1 |
7106 |
27.4 |
0.9 |
0.705 |
0 |
0 |
0 |
0.000 |
59 |
|
A |
4 |
2 |
7235 |
◊ |
D |
x,y-1,z |
1_545 |
1 |
1 |
7319 |
26.9 |
0.7 |
0.668 |
0 |
0 |
0 |
0.000 |
60 |
|
A |
2 |
1 |
7235 |
◊ |
G |
x-1,y-1,z |
1_445 |
3 |
2 |
7106 |
25.6 |
0.7 |
0.639 |
0 |
0 |
0 |
0.000 |
Average: |
26.6 |
0.8 |
0.671 |
0 |
0 |
0 |
0.000 |
37 |
61 |
|
[NAG]B:202 |
1 |
1 |
360 |
f |
[NAG]B:201 |
x,y,z |
1_555 |
2 |
1 |
359 |
24.1 |
1.1 |
0.415 |
0 |
0 |
0 |
0.000 |
38 |
62 |
|
[NAG]E:202 |
2 |
1 |
365 |
f |
[NAG]E:201 |
x,y,z |
1_555 |
1 |
1 |
357 |
11.9 |
0.8 |
0.439 |
0 |
0 |
0 |
0.000 |
39 |
63 |
|
Y |
3 |
1 |
13547 |
◊ |
H |
-y,x-y,z+1/3 |
2_555 |
4 |
1 |
8314 |
8.7 |
-0.1 |
0.540 |
0 |
0 |
0 |
0.000 |
40 |
64 |
|
[EDO]X:401 |
1 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
2 |
1 |
7235 |
4.7 |
0.1 |
0.835 |
0 |
0 |
0 |
0.000 |
41 |
65 |
|
X |
1 |
1 |
13995 |
◊ |
Y |
-y,x-y,z+1/3 |
2_555 |
1 |
1 |
13547 |
2.2 |
-0.0 |
0.548 |
0 |
0 |
0 |
0.000 |
|