## |
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 |
|
C |
42 |
7 |
1239 |
◊ |
B |
x,x-y+1,-z+1/6 |
12_565 |
37 |
7 |
1251 |
297.7 |
-1.9 |
0.636 |
2 |
0 |
0 |
0.000 |
2 |
2 |
|
D |
18 |
3 |
1202 |
◊ |
A |
-y+1,x-y+1,z+1/3 |
2_665 |
18 |
5 |
1234 |
163.1 |
0.4 |
0.703 |
2 |
0 |
0 |
0.000 |
3 |
3 |
|
D |
20 |
5 |
1202 |
◊ |
C |
x,y,z |
1_555 |
21 |
5 |
1239 |
155.5 |
-2.1 |
0.467 |
6 |
0 |
0 |
0.000 |
4 |
|
B |
20 |
5 |
1251 |
◊ |
A |
x,y,z |
1_555 |
20 |
5 |
1234 |
154.1 |
-2.7 |
0.415 |
6 |
0 |
0 |
0.000 |
Average: |
154.8 |
-2.4 |
0.441 |
6 |
0 |
0 |
0.000 |
4 |
5 |
|
A |
24 |
5 |
1234 |
◊ |
D |
x-y,-y+1,-z |
8_565 |
18 |
3 |
1202 |
155.1 |
-1.3 |
0.553 |
1 |
0 |
0 |
0.000 |
5 |
6 |
|
[GOL]D:1001 |
6 |
1 |
219 |
f |
D |
x,y,z |
1_555 |
24 |
6 |
1202 |
113.2 |
-0.8 |
0.558 |
0 |
0 |
0 |
0.000 |
6 |
7 |
|
C |
12 |
3 |
1239 |
◊ |
C |
x,x-y+1,-z+1/6 |
12_565 |
12 |
3 |
1239 |
89.6 |
-4.2 |
0.162 |
4 |
0 |
0 |
0.000 |
7 |
8 |
|
[GOL]B:1002 |
6 |
1 |
216 |
◊ |
[GOL]B:1002 |
-y+1,-x+1,-z-1/6 |
10_664 |
6 |
1 |
216 |
86.1 |
-0.9 |
0.436 |
0 |
0 |
0 |
0.000 |
8 |
9 |
|
[ERE]D:8 |
7 |
1 |
297 |
cf |
D |
x,y,z |
1_555 |
10 |
2 |
1202 |
79.8 |
2.0 |
0.562 |
0 |
0 |
0 |
0.000 |
10 |
|
[ERE]C:8 |
6 |
1 |
297 |
cf |
C |
x,y,z |
1_555 |
10 |
2 |
1239 |
76.4 |
1.9 |
0.568 |
0 |
0 |
0 |
0.000 |
11 |
|
[ERE]A:8 |
7 |
1 |
298 |
cf |
A |
x,y,z |
1_555 |
10 |
2 |
1234 |
74.8 |
1.9 |
0.524 |
0 |
0 |
0 |
0.000 |
12 |
|
[ERE]B:8 |
6 |
1 |
295 |
cf |
B |
x,y,z |
1_555 |
10 |
2 |
1251 |
73.6 |
1.8 |
0.538 |
0 |
0 |
0 |
0.000 |
Average: |
76.1 |
1.9 |
0.548 |
0 |
0 |
0 |
0.000 |
9 |
13 |
|
[ERE]C:8 |
4 |
1 |
297 |
◊ |
D |
x,y,z |
1_555 |
8 |
2 |
1202 |
66.5 |
-0.4 |
0.315 |
1 |
0 |
0 |
0.000 |
14 |
|
[ERE]B:8 |
4 |
1 |
295 |
◊ |
A |
x,y,z |
1_555 |
7 |
2 |
1234 |
66.2 |
0.1 |
0.345 |
1 |
0 |
0 |
0.000 |
15 |
|
[ERE]D:8 |
4 |
1 |
297 |
◊ |
C |
x,y,z |
1_555 |
8 |
2 |
1239 |
66.0 |
0.2 |
0.320 |
1 |
0 |
0 |
0.000 |
16 |
|
[ERE]A:8 |
4 |
1 |
298 |
◊ |
B |
x,y,z |
1_555 |
8 |
2 |
1251 |
64.7 |
-0.2 |
0.330 |
1 |
0 |
0 |
0.000 |
Average: |
65.9 |
-0.0 |
0.328 |
1 |
0 |
0 |
0.000 |
10 |
17 |
|
[BGC]D:9 |
6 |
1 |
294 |
cf |
D |
x,y,z |
1_555 |
10 |
3 |
1202 |
65.2 |
0.5 |
0.321 |
1 |
0 |
0 |
0.000 |
18 |
|
[BGC]A:9 |
6 |
1 |
292 |
cf |
A |
x,y,z |
1_555 |
10 |
3 |
1234 |
65.2 |
0.5 |
0.307 |
2 |
0 |
0 |
0.000 |
Average: |
65.2 |
0.5 |
0.314 |
2 |
0 |
0 |
0.000 |
11 |
19 |
|
[BGC]B:9 |
7 |
1 |
293 |
cf |
B |
x,y,z |
1_555 |
7 |
3 |
1251 |
64.3 |
-1.1 |
0.132 |
1 |
0 |
0 |
0.000 |
20 |
|
[BGC]C:9 |
6 |
1 |
293 |
cf |
C |
x,y,z |
1_555 |
8 |
3 |
1239 |
50.4 |
-0.8 |
0.181 |
0 |
0 |
0 |
0.000 |
Average: |
57.3 |
-0.9 |
0.156 |
1 |
0 |
0 |
0.000 |
12 |
21 |
|
[RAM]A:10 |
6 |
1 |
281 |
f |
A |
x,y,z |
1_555 |
8 |
2 |
1234 |
60.7 |
-1.5 |
0.142 |
0 |
0 |
0 |
0.000 |
22 |
|
[RAM]D:10 |
6 |
1 |
280 |
f |
D |
x,y,z |
1_555 |
7 |
2 |
1202 |
55.3 |
-1.4 |
0.138 |
0 |
0 |
0 |
0.000 |
Average: |
58.0 |
-1.4 |
0.140 |
0 |
0 |
0 |
0.000 |
13 |
23 |
|
[RAM]D:10 |
6 |
1 |
280 |
cf |
[BGC]D:9 |
x,y,z |
1_555 |
4 |
1 |
294 |
55.5 |
2.6 |
0.305 |
0 |
0 |
0 |
0.000 |
24 |
|
[RAM]A:10 |
6 |
1 |
281 |
cf |
[BGC]A:9 |
x,y,z |
1_555 |
5 |
1 |
292 |
54.6 |
2.6 |
0.309 |
0 |
0 |
0 |
0.000 |
25 |
|
[RAM]B:10 |
6 |
1 |
280 |
cf |
[BGC]B:9 |
x,y,z |
1_555 |
5 |
1 |
293 |
54.5 |
2.5 |
0.297 |
0 |
0 |
0 |
0.000 |
26 |
|
[RAM]C:10 |
6 |
1 |
281 |
cf |
[BGC]C:9 |
x,y,z |
1_555 |
4 |
1 |
293 |
44.7 |
2.1 |
0.299 |
0 |
0 |
0 |
0.000 |
Average: |
52.3 |
2.5 |
0.302 |
0 |
0 |
0 |
0.000 |
14 |
27 |
|
[BGC]A:9 |
5 |
1 |
292 |
◊ |
D |
x-y,-y+1,-z |
8_565 |
5 |
2 |
1202 |
53.5 |
0.7 |
0.298 |
0 |
0 |
0 |
0.000 |
15 |
28 |
|
[GOL]B:1002 |
3 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
9 |
2 |
1251 |
52.6 |
-0.6 |
0.465 |
1 |
0 |
0 |
0.000 |
16 |
29 |
|
[RAM]B:10 |
6 |
1 |
280 |
f |
B |
x,y,z |
1_555 |
10 |
3 |
1251 |
52.2 |
0.4 |
0.264 |
0 |
0 |
0 |
0.000 |
30 |
|
[RAM]C:10 |
6 |
1 |
281 |
f |
C |
x,y,z |
1_555 |
9 |
3 |
1239 |
45.1 |
0.4 |
0.249 |
0 |
0 |
0 |
0.000 |
Average: |
48.6 |
0.4 |
0.257 |
0 |
0 |
0 |
0.000 |
17 |
31 |
|
[RAM]C:10 |
5 |
1 |
281 |
◊ |
B |
x,y,z |
1_555 |
8 |
2 |
1251 |
51.7 |
1.1 |
0.407 |
0 |
0 |
0 |
0.000 |
18 |
32 |
|
[RAM]B:10 |
7 |
1 |
280 |
◊ |
B |
x,x-y+1,-z+1/6 |
12_565 |
9 |
2 |
1251 |
50.6 |
-0.2 |
0.194 |
0 |
0 |
0 |
0.000 |
19 |
33 |
|
[BGC]B:9 |
6 |
1 |
293 |
◊ |
[BGC]A:9 |
x,y,z |
1_555 |
8 |
1 |
292 |
50.4 |
1.4 |
0.135 |
0 |
0 |
0 |
0.000 |
34 |
|
[BGC]D:9 |
7 |
1 |
294 |
◊ |
[BGC]C:9 |
x,y,z |
1_555 |
5 |
1 |
293 |
40.2 |
1.2 |
0.150 |
0 |
0 |
0 |
0.000 |
Average: |
45.3 |
1.3 |
0.143 |
0 |
0 |
0 |
0.000 |
20 |
35 |
|
[BGC]B:9 |
6 |
1 |
293 |
◊ |
A |
x,y,z |
1_555 |
9 |
2 |
1234 |
47.0 |
0.8 |
0.351 |
0 |
0 |
0 |
0.000 |
36 |
|
[BGC]C:9 |
6 |
1 |
293 |
◊ |
D |
x,y,z |
1_555 |
10 |
2 |
1202 |
43.1 |
0.5 |
0.390 |
0 |
0 |
0 |
0.000 |
Average: |
45.0 |
0.7 |
0.371 |
0 |
0 |
0 |
0.000 |
21 |
37 |
|
[GOL]B:1002 |
4 |
1 |
216 |
◊ |
B |
-y+1,-x+1,-z-1/6 |
10_664 |
10 |
2 |
1251 |
46.8 |
-0.4 |
0.526 |
1 |
0 |
0 |
0.000 |
22 |
38 |
|
[RAM]C:10 |
4 |
1 |
281 |
◊ |
C |
x,x-y+1,-z+1/6 |
12_565 |
5 |
2 |
1239 |
46.1 |
0.8 |
0.429 |
1 |
0 |
0 |
0.000 |
23 |
39 |
|
C |
6 |
2 |
1239 |
◊ |
A |
-y+1,x-y+1,z+1/3 |
2_665 |
8 |
3 |
1234 |
45.6 |
0.9 |
0.699 |
0 |
0 |
0 |
0.000 |
24 |
40 |
|
[GOL]D:1001 |
4 |
1 |
219 |
f |
[BGC]D:9 |
x,y,z |
1_555 |
4 |
1 |
294 |
41.1 |
0.3 |
0.374 |
1 |
0 |
0 |
0.000 |
25 |
41 |
|
[RAM]A:10 |
4 |
1 |
281 |
◊ |
[BGC]B:9 |
x,y,z |
1_555 |
5 |
1 |
293 |
40.1 |
1.2 |
0.212 |
0 |
0 |
0 |
0.000 |
42 |
|
[RAM]D:10 |
5 |
1 |
280 |
◊ |
[BGC]C:9 |
x,y,z |
1_555 |
5 |
1 |
293 |
39.0 |
1.1 |
0.174 |
0 |
0 |
0 |
0.000 |
Average: |
39.5 |
1.1 |
0.193 |
0 |
0 |
0 |
0.000 |
26 |
43 |
|
[BGC]C:9 |
6 |
1 |
293 |
◊ |
C |
x,x-y+1,-z+1/6 |
12_565 |
7 |
2 |
1239 |
35.4 |
0.5 |
0.286 |
0 |
0 |
0 |
0.000 |
27 |
44 |
|
[RAM]B:10 |
3 |
1 |
280 |
◊ |
C |
x,x-y+1,-z+1/6 |
12_565 |
3 |
1 |
1239 |
34.5 |
0.0 |
0.279 |
0 |
0 |
0 |
0.000 |
45 |
|
[RAM]C:10 |
3 |
1 |
281 |
◊ |
B |
x,x-y+1,-z+1/6 |
12_565 |
2 |
1 |
1251 |
31.7 |
0.1 |
0.226 |
0 |
0 |
0 |
0.000 |
Average: |
33.1 |
0.1 |
0.253 |
0 |
0 |
0 |
0.000 |
28 |
46 |
|
[BGC]C:9 |
6 |
1 |
293 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
1251 |
33.1 |
0.7 |
0.317 |
1 |
0 |
0 |
0.000 |
29 |
47 |
|
[RAM]B:10 |
4 |
1 |
280 |
◊ |
[RAM]A:10 |
x,y,z |
1_555 |
2 |
1 |
281 |
29.5 |
1.7 |
0.423 |
0 |
0 |
0 |
0.000 |
48 |
|
[RAM]D:10 |
3 |
1 |
280 |
◊ |
[RAM]C:10 |
x,y,z |
1_555 |
4 |
1 |
281 |
28.3 |
1.6 |
0.332 |
0 |
0 |
0 |
0.000 |
Average: |
28.9 |
1.7 |
0.378 |
0 |
0 |
0 |
0.000 |
30 |
49 |
|
[BGC]C:9 |
4 |
1 |
293 |
◊ |
[ERE]D:8 |
x,x-y+1,-z+1/6 |
12_565 |
3 |
1 |
297 |
28.5 |
0.9 |
0.306 |
1 |
0 |
0 |
0.000 |
31 |
50 |
|
[RAM]C:10 |
3 |
1 |
281 |
◊ |
[ERE]B:8 |
x,y,z |
1_555 |
3 |
1 |
295 |
26.1 |
1.1 |
0.381 |
0 |
0 |
0 |
0.000 |
32 |
51 |
|
[RAM]D:10 |
1 |
1 |
280 |
◊ |
C |
x,y,z |
1_555 |
6 |
2 |
1239 |
25.2 |
0.6 |
0.589 |
0 |
0 |
0 |
0.000 |
33 |
52 |
|
[ERE]A:8 |
4 |
1 |
298 |
◊ |
D |
x-y,-y+1,-z |
8_565 |
3 |
1 |
1202 |
23.9 |
0.4 |
0.449 |
0 |
0 |
0 |
0.000 |
34 |
53 |
|
[RAM]A:10 |
1 |
1 |
281 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
1251 |
19.6 |
0.5 |
0.617 |
0 |
0 |
0 |
0.000 |
35 |
54 |
|
[RAM]B:10 |
1 |
1 |
280 |
◊ |
[RAM]B:10 |
x,x-y+1,-z+1/6 |
12_565 |
1 |
1 |
280 |
18.7 |
1.2 |
0.800 |
0 |
0 |
0 |
0.000 |
36 |
55 |
|
A |
1 |
1 |
1234 |
◊ |
A |
-x,-x+y,-z-1/3 |
9_554 |
1 |
1 |
1234 |
12.3 |
0.4 |
0.768 |
0 |
0 |
0 |
0.000 |
37 |
56 |
|
C |
2 |
1 |
1239 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
1251 |
12.1 |
-0.4 |
0.290 |
0 |
0 |
0 |
0.000 |
38 |
57 |
|
[BGC]A:9 |
1 |
1 |
292 |
◊ |
[BGC]D:9 |
x-y,-y+1,-z |
8_565 |
2 |
1 |
294 |
9.2 |
-0.0 |
0.219 |
0 |
0 |
0 |
0.000 |
39 |
58 |
|
[RAM]C:10 |
1 |
1 |
281 |
◊ |
[RAM]B:10 |
x,y,z |
1_555 |
1 |
1 |
280 |
8.8 |
0.1 |
0.200 |
0 |
0 |
0 |
0.000 |
40 |
59 |
|
[RAM]B:10 |
1 |
1 |
280 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
1239 |
7.1 |
0.1 |
0.246 |
0 |
0 |
0 |
0.000 |
41 |
60 |
|
[ERE]A:8 |
1 |
1 |
298 |
◊ |
[ERE]C:8 |
x-y,-y+1,-z |
8_565 |
1 |
1 |
297 |
7.0 |
0.3 |
0.430 |
0 |
0 |
0 |
0.000 |
42 |
61 |
|
[BGC]A:9 |
1 |
1 |
292 |
◊ |
[GOL]D:1001 |
x-y,-y+1,-z |
8_565 |
1 |
1 |
219 |
6.4 |
0.3 |
0.369 |
0 |
0 |
0 |
0.000 |
43 |
62 |
|
B |
2 |
2 |
1251 |
◊ |
B |
-y+1,-x+1,-z-1/6 |
10_664 |
2 |
2 |
1251 |
4.5 |
-0.1 |
0.479 |
0 |
0 |
0 |
0.000 |
44 |
63 |
|
[ERE]D:8 |
1 |
1 |
297 |
◊ |
B |
x,x-y+1,-z+1/6 |
12_565 |
1 |
1 |
1251 |
4.0 |
0.1 |
0.479 |
0 |
0 |
0 |
0.000 |
45 |
64 |
|
[ERE]D:8 |
1 |
1 |
297 |
◊ |
C |
x,x-y+1,-z+1/6 |
12_565 |
1 |
1 |
1239 |
3.7 |
-0.2 |
0.256 |
0 |
0 |
0 |
0.000 |
46 |
65 |
|
D |
3 |
2 |
1202 |
◊ |
D |
y,x,-z+1/3 |
7_555 |
3 |
2 |
1202 |
2.9 |
-0.0 |
0.573 |
0 |
0 |
0 |
0.000 |
47 |
66 |
|
[BGC]C:9 |
1 |
1 |
293 |
◊ |
B |
x,x-y+1,-z+1/6 |
12_565 |
1 |
1 |
1251 |
1.3 |
0.0 |
0.330 |
0 |
0 |
0 |
0.000 |
|