## |
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 |
184 |
47 |
13644 |
◊ |
B |
x,y,z |
1_555 |
182 |
48 |
14386 |
1930.6 |
-25.5 |
0.012 |
25 |
15 |
0 |
1.000 |
2 |
|
C |
186 |
48 |
14093 |
◊ |
A |
x,y,z |
1_555 |
180 |
49 |
14194 |
1906.0 |
-30.5 |
0.004 |
24 |
14 |
0 |
1.000 |
Average: |
1918.3 |
-28.0 |
0.008 |
25 |
15 |
0 |
1.000 |
2 |
3 |
|
A |
82 |
19 |
14194 |
◊ |
B |
x-1,y,z |
1_455 |
100 |
30 |
14386 |
790.5 |
2.1 |
0.824 |
6 |
4 |
0 |
0.000 |
4 |
|
B |
83 |
19 |
14386 |
◊ |
A |
x,y,z |
1_555 |
95 |
30 |
14194 |
767.3 |
1.8 |
0.809 |
8 |
4 |
0 |
0.000 |
Average: |
778.9 |
2.0 |
0.817 |
7 |
4 |
0 |
0.000 |
3 |
5 |
|
B |
75 |
23 |
14386 |
◊ |
C |
x,y,z-1 |
1_554 |
48 |
18 |
14093 |
582.9 |
-5.9 |
0.202 |
5 |
0 |
0 |
0.000 |
4 |
6 |
|
A |
34 |
8 |
14194 |
◊ |
C |
x-1,y,z |
1_455 |
45 |
13 |
14093 |
322.6 |
-1.7 |
0.461 |
4 |
0 |
0 |
0.000 |
7 |
|
B |
29 |
8 |
14386 |
◊ |
D |
x-1,y,z |
1_455 |
46 |
12 |
13644 |
309.0 |
-2.4 |
0.399 |
4 |
0 |
0 |
0.000 |
Average: |
315.8 |
-2.1 |
0.430 |
4 |
0 |
0 |
0.000 |
5 |
8 |
|
C |
40 |
9 |
14093 |
◊ |
A |
-x,y-1/2,-z+1 |
2_546 |
35 |
15 |
14194 |
273.7 |
0.6 |
0.749 |
0 |
1 |
0 |
0.000 |
6 |
9 |
|
C |
20 |
5 |
14093 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
25 |
10 |
14386 |
201.1 |
-0.7 |
0.448 |
3 |
0 |
0 |
0.000 |
7 |
10 |
|
A |
29 |
8 |
14194 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
21 |
4 |
13644 |
195.0 |
1.0 |
0.714 |
3 |
0 |
0 |
0.000 |
8 |
11 |
|
A |
21 |
10 |
14194 |
◊ |
D |
x-1,y,z+1 |
1_456 |
24 |
8 |
13644 |
184.5 |
2.6 |
0.875 |
1 |
2 |
0 |
0.000 |
9 |
12 |
|
[AKG]C:401 |
9 |
1 |
275 |
cf |
C |
x,y,z |
1_555 |
30 |
10 |
14093 |
157.8 |
2.7 |
0.495 |
6 |
0 |
0 |
0.035 |
13 |
|
[AKG]D:401 |
9 |
1 |
275 |
cf |
D |
x,y,z |
1_555 |
29 |
10 |
13644 |
157.7 |
2.5 |
0.469 |
6 |
0 |
0 |
0.035 |
14 |
|
[AKG]A:401 |
9 |
1 |
275 |
cf |
A |
x,y,z |
1_555 |
29 |
11 |
14194 |
156.3 |
1.4 |
0.476 |
6 |
0 |
0 |
0.035 |
15 |
|
[AKG]B:401 |
9 |
1 |
273 |
cf |
B |
x,y,z |
1_555 |
29 |
10 |
14386 |
154.2 |
2.7 |
0.480 |
6 |
0 |
0 |
0.035 |
Average: |
156.5 |
2.3 |
0.480 |
6 |
0 |
0 |
0.035 |
10 |
16 |
|
[CAC]B:408 |
5 |
1 |
237 |
f |
B |
x,y,z |
1_555 |
25 |
13 |
14386 |
156.0 |
4.5 |
0.469 |
0 |
0 |
0 |
0.000 |
17 |
|
[CAC]D:404 |
5 |
1 |
236 |
f |
D |
x,y,z |
1_555 |
23 |
13 |
13644 |
153.3 |
4.8 |
0.477 |
0 |
0 |
0 |
0.000 |
Average: |
154.7 |
4.6 |
0.473 |
0 |
0 |
0 |
0.000 |
11 |
18 |
|
[CAC]A:410 |
5 |
1 |
236 |
f |
A |
x,y,z |
1_555 |
26 |
14 |
14194 |
153.9 |
4.9 |
0.510 |
0 |
0 |
0 |
0.000 |
12 |
19 |
|
[CAC]C:404 |
5 |
1 |
236 |
f |
C |
x,y,z |
1_555 |
26 |
12 |
14093 |
149.6 |
4.2 |
0.483 |
0 |
0 |
0 |
0.000 |
13 |
20 |
|
[CAC]C:405 |
5 |
1 |
236 |
f |
C |
x,y,z |
1_555 |
23 |
13 |
14093 |
148.2 |
5.0 |
0.522 |
0 |
0 |
0 |
0.000 |
14 |
21 |
|
[GOL]D:403 |
6 |
1 |
218 |
f |
D |
x,y,z |
1_555 |
20 |
10 |
13644 |
142.0 |
-0.7 |
0.472 |
7 |
0 |
0 |
1.000 |
15 |
22 |
|
[CAC]A:409 |
5 |
1 |
236 |
◊ |
A |
x,y,z |
1_555 |
18 |
9 |
14194 |
116.0 |
3.7 |
0.404 |
0 |
0 |
0 |
0.000 |
16 |
23 |
|
[GOL]A:405 |
6 |
1 |
220 |
◊ |
A |
x,y,z |
1_555 |
17 |
7 |
14194 |
115.4 |
0.3 |
0.670 |
2 |
0 |
0 |
0.000 |
17 |
24 |
|
[CAC]B:407 |
5 |
1 |
237 |
◊ |
B |
x,y,z |
1_555 |
17 |
9 |
14386 |
112.8 |
2.8 |
0.288 |
0 |
0 |
0 |
0.000 |
18 |
25 |
|
[GOL]B:402 |
6 |
1 |
214 |
◊ |
B |
x,y,z |
1_555 |
18 |
7 |
14386 |
109.4 |
0.1 |
0.683 |
2 |
0 |
0 |
0.000 |
19 |
26 |
|
B |
13 |
5 |
14386 |
◊ |
D |
-x+1,y-1/2,-z |
2_645 |
12 |
4 |
13644 |
106.9 |
2.7 |
0.891 |
1 |
1 |
0 |
0.000 |
20 |
27 |
|
[GOL]D:402 |
6 |
1 |
219 |
f |
D |
x,y,z |
1_555 |
15 |
6 |
13644 |
106.3 |
-0.3 |
0.567 |
2 |
0 |
0 |
0.329 |
21 |
28 |
|
[GOL]B:405 |
6 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
16 |
6 |
14386 |
104.8 |
-0.5 |
0.534 |
1 |
0 |
0 |
0.023 |
22 |
29 |
|
[GOL]A:407 |
6 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
14194 |
104.7 |
-0.2 |
0.565 |
3 |
0 |
0 |
0.044 |
23 |
30 |
|
[GOL]A:408 |
5 |
1 |
215 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
14194 |
101.6 |
0.5 |
0.759 |
4 |
0 |
0 |
0.035 |
24 |
31 |
|
[GOL]B:406 |
6 |
1 |
215 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
14386 |
100.6 |
0.5 |
0.668 |
3 |
0 |
0 |
0.022 |
25 |
32 |
|
C |
12 |
5 |
14093 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
14386 |
99.7 |
1.9 |
0.781 |
2 |
0 |
0 |
0.000 |
33 |
|
A |
6 |
4 |
14194 |
◊ |
D |
x-1,y,z |
1_455 |
10 |
4 |
13644 |
81.6 |
1.0 |
0.719 |
1 |
0 |
0 |
0.000 |
Average: |
90.6 |
1.5 |
0.750 |
2 |
0 |
0 |
0.000 |
26 |
34 |
|
[GOL]A:404 |
5 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
14194 |
94.4 |
-0.8 |
0.445 |
2 |
0 |
0 |
0.047 |
27 |
35 |
|
[GOL]B:404 |
6 |
1 |
219 |
◊ |
B |
x,y,z |
1_555 |
14 |
6 |
14386 |
93.4 |
1.0 |
0.700 |
3 |
0 |
0 |
0.000 |
28 |
36 |
|
[GOL]A:402 |
5 |
1 |
220 |
◊ |
A |
x,y,z |
1_555 |
20 |
7 |
14194 |
92.7 |
-0.9 |
0.470 |
0 |
0 |
0 |
0.000 |
29 |
37 |
|
[GOL]C:403 |
6 |
1 |
219 |
f |
C |
x,y,z |
1_555 |
10 |
6 |
14093 |
91.5 |
-1.0 |
0.344 |
4 |
0 |
0 |
0.069 |
30 |
38 |
|
[GOL]A:402 |
6 |
1 |
220 |
f |
B |
x-1,y,z |
1_455 |
15 |
5 |
14386 |
91.3 |
-0.6 |
0.505 |
2 |
0 |
0 |
0.038 |
31 |
39 |
|
[GOL]C:402 |
6 |
1 |
219 |
f |
A |
-x,y-1/2,-z+1 |
2_546 |
16 |
10 |
14194 |
89.2 |
0.1 |
0.650 |
2 |
0 |
0 |
0.022 |
32 |
40 |
|
[GOL]A:404 |
5 |
1 |
219 |
◊ |
B |
x,y,z |
1_555 |
19 |
7 |
14386 |
88.2 |
-0.8 |
0.457 |
0 |
0 |
0 |
0.000 |
33 |
41 |
|
C |
15 |
6 |
14093 |
f |
[GOL]A:403 |
-x,y-1/2,-z+1 |
2_546 |
5 |
1 |
219 |
80.7 |
-0.8 |
0.466 |
1 |
0 |
0 |
0.030 |
34 |
42 |
|
[GOL]B:403 |
6 |
1 |
222 |
◊ |
B |
x,y,z |
1_555 |
12 |
4 |
14386 |
80.2 |
0.6 |
0.638 |
2 |
0 |
0 |
0.000 |
35 |
43 |
|
B |
6 |
3 |
14386 |
x |
B |
x-1,y,z |
1_455 |
10 |
4 |
14386 |
78.7 |
-1.1 |
0.199 |
0 |
0 |
0 |
0.000 |
44 |
|
A |
7 |
3 |
14194 |
x |
A |
x-1,y,z |
1_455 |
8 |
2 |
14194 |
70.2 |
-0.7 |
0.346 |
0 |
0 |
0 |
0.000 |
Average: |
74.5 |
-0.9 |
0.273 |
0 |
0 |
0 |
0.000 |
36 |
45 |
|
[GOL]A:403 |
6 |
1 |
219 |
◊ |
A |
x,y,z |
1_555 |
13 |
5 |
14194 |
77.9 |
0.1 |
0.645 |
1 |
0 |
0 |
0.000 |
37 |
46 |
|
B |
11 |
5 |
14386 |
◊ |
[GOL]C:403 |
x,y,z-1 |
1_554 |
5 |
1 |
219 |
75.4 |
-0.2 |
0.539 |
1 |
0 |
0 |
0.000 |
38 |
47 |
|
A |
12 |
3 |
14194 |
f |
[GOL]B:404 |
x-1,y,z |
1_455 |
5 |
1 |
219 |
72.4 |
-0.6 |
0.501 |
2 |
0 |
0 |
0.040 |
39 |
48 |
|
[GOL]B:403 |
5 |
1 |
222 |
f |
C |
x,y,z-1 |
1_554 |
9 |
5 |
14093 |
69.7 |
-0.0 |
0.550 |
1 |
0 |
0 |
0.012 |
40 |
49 |
|
[GOL]A:405 |
4 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
14386 |
67.8 |
-0.7 |
0.402 |
0 |
0 |
0 |
0.017 |
41 |
50 |
|
A |
7 |
3 |
14194 |
f |
[GOL]B:402 |
x-1,y,z |
1_455 |
4 |
1 |
214 |
62.4 |
-0.6 |
0.485 |
1 |
0 |
0 |
0.028 |
42 |
51 |
|
[GOL]C:402 |
5 |
1 |
219 |
◊ |
C |
x,y,z |
1_555 |
10 |
5 |
14093 |
59.7 |
-0.3 |
0.544 |
1 |
0 |
0 |
0.000 |
43 |
52 |
|
[GOL]D:402 |
4 |
1 |
219 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
14386 |
55.2 |
-0.3 |
0.546 |
0 |
0 |
0 |
0.008 |
44 |
53 |
|
[GOL]B:405 |
5 |
1 |
218 |
◊ |
D |
x,y,z |
1_555 |
7 |
4 |
13644 |
52.1 |
0.1 |
0.605 |
1 |
0 |
0 |
0.009 |
45 |
54 |
|
[GOL]A:407 |
4 |
1 |
218 |
◊ |
C |
x,y,z |
1_555 |
7 |
4 |
14093 |
51.4 |
-0.5 |
0.457 |
0 |
0 |
0 |
0.013 |
46 |
55 |
|
[GOL]B:406 |
4 |
1 |
215 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
14194 |
51.0 |
-0.3 |
0.505 |
0 |
0 |
0 |
0.000 |
47 |
56 |
|
[GOL]A:408 |
4 |
1 |
215 |
◊ |
B |
x-1,y,z |
1_455 |
6 |
2 |
14386 |
48.0 |
0.3 |
0.688 |
2 |
0 |
0 |
0.000 |
48 |
57 |
|
[CAC]C:405 |
3 |
1 |
236 |
f |
[CAC]C:404 |
x,y,z |
1_555 |
3 |
1 |
236 |
43.1 |
2.4 |
0.181 |
0 |
0 |
0 |
0.000 |
49 |
58 |
|
[GOL]C:402 |
4 |
1 |
219 |
◊ |
[GOL]A:403 |
-x,y-1/2,-z+1 |
2_546 |
3 |
1 |
219 |
40.1 |
0.5 |
0.696 |
3 |
0 |
0 |
0.000 |
50 |
59 |
|
D |
4 |
2 |
13644 |
◊ |
C |
x,y,z-1 |
1_554 |
5 |
3 |
14093 |
39.4 |
-1.0 |
0.241 |
0 |
0 |
0 |
0.000 |
51 |
60 |
|
[CAC]A:409 |
4 |
1 |
236 |
f |
B |
x,y,z |
1_555 |
3 |
1 |
14386 |
37.5 |
0.1 |
0.067 |
0 |
0 |
0 |
0.000 |
52 |
61 |
|
[GOL]A:406 |
3 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
14194 |
33.6 |
0.2 |
0.683 |
0 |
0 |
0 |
0.000 |
53 |
62 |
|
A |
3 |
1 |
14194 |
◊ |
[CAC]B:407 |
x-1,y,z |
1_455 |
3 |
1 |
237 |
32.5 |
0.1 |
0.139 |
0 |
0 |
0 |
0.000 |
54 |
63 |
|
[GOL]B:403 |
4 |
1 |
222 |
f |
[GOL]C:403 |
x,y,z-1 |
1_554 |
2 |
1 |
219 |
32.0 |
0.4 |
0.614 |
1 |
0 |
0 |
0.002 |
55 |
64 |
|
[GOL]B:406 |
2 |
1 |
215 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
14093 |
25.9 |
-0.1 |
0.336 |
0 |
0 |
0 |
0.000 |
56 |
65 |
|
[GOL]A:408 |
2 |
1 |
215 |
◊ |
D |
x-1,y,z |
1_455 |
1 |
1 |
13644 |
22.2 |
-0.3 |
0.244 |
0 |
0 |
0 |
0.000 |
57 |
66 |
|
[AKG]D:401 |
3 |
1 |
275 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
14386 |
20.1 |
-0.1 |
0.208 |
0 |
0 |
0 |
0.000 |
67 |
|
[AKG]C:401 |
3 |
1 |
275 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
14194 |
19.1 |
-0.0 |
0.220 |
0 |
0 |
0 |
0.000 |
68 |
|
[AKG]B:401 |
3 |
1 |
273 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
13644 |
19.1 |
0.0 |
0.216 |
0 |
0 |
0 |
0.000 |
69 |
|
[AKG]A:401 |
3 |
1 |
275 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
14093 |
18.2 |
-0.0 |
0.266 |
0 |
0 |
0 |
0.000 |
Average: |
19.1 |
-0.0 |
0.228 |
0 |
0 |
0 |
0.001 |
58 |
70 |
|
C |
3 |
1 |
14093 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
3 |
2 |
13644 |
16.9 |
0.1 |
0.678 |
0 |
0 |
0 |
0.000 |
59 |
71 |
|
[GOL]B:404 |
1 |
1 |
219 |
f |
[GOL]B:402 |
x,y,z |
1_555 |
1 |
1 |
214 |
13.1 |
0.3 |
0.500 |
0 |
0 |
0 |
0.000 |
60 |
72 |
|
C |
3 |
2 |
14093 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
2 |
1 |
13644 |
12.5 |
0.2 |
0.711 |
0 |
0 |
0 |
0.000 |
61 |
73 |
|
[CAC]B:407 |
1 |
1 |
237 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
14194 |
4.4 |
0.1 |
0.264 |
0 |
0 |
0 |
0.000 |
62 |
74 |
|
C |
1 |
1 |
14093 |
x |
C |
x-1,y,z |
1_455 |
1 |
1 |
14093 |
0.3 |
0.0 |
0.651 |
0 |
0 |
0 |
0.000 |
|