## |
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 |
177 |
41 |
12799 |
◊ |
A |
x,y,z |
1_555 |
177 |
41 |
12625 |
1768.8 |
-12.0 |
0.423 |
19 |
27 |
0 |
0.559 |
2 |
|
B |
179 |
40 |
12364 |
◊ |
C |
x-1,y,z |
1_455 |
174 |
41 |
12338 |
1762.5 |
-13.2 |
0.407 |
18 |
21 |
0 |
0.559 |
Average: |
1765.6 |
-12.6 |
0.415 |
19 |
24 |
0 |
0.559 |
2 |
3 |
|
A |
67 |
23 |
12625 |
◊ |
D |
x,y-1,z |
1_545 |
63 |
20 |
12799 |
588.2 |
-4.4 |
0.459 |
4 |
0 |
0 |
0.009 |
3 |
4 |
|
[GY0]D:405 |
20 |
1 |
548 |
f |
D |
x,y,z |
1_555 |
50 |
21 |
12799 |
373.2 |
-9.8 |
0.169 |
3 |
0 |
0 |
0.255 |
4 |
5 |
|
A |
35 |
13 |
12625 |
◊ |
C |
x-1,y,z+1 |
1_456 |
34 |
13 |
12338 |
329.0 |
1.8 |
0.866 |
10 |
0 |
0 |
0.061 |
5 |
6 |
|
A |
32 |
12 |
12625 |
◊ |
D |
x-1,y,z |
1_455 |
36 |
9 |
12799 |
306.2 |
-0.7 |
0.656 |
4 |
1 |
0 |
0.000 |
7 |
|
C |
31 |
11 |
12338 |
◊ |
B |
x,y,z |
1_555 |
36 |
9 |
12364 |
270.7 |
-2.5 |
0.432 |
3 |
0 |
0 |
0.000 |
Average: |
288.5 |
-1.6 |
0.544 |
4 |
1 |
0 |
0.000 |
6 |
8 |
|
D |
28 |
13 |
12799 |
◊ |
C |
x,y,z |
1_555 |
31 |
10 |
12338 |
240.8 |
3.0 |
0.918 |
3 |
4 |
0 |
0.000 |
9 |
|
B |
25 |
11 |
12364 |
◊ |
A |
x,y,z |
1_555 |
26 |
8 |
12625 |
234.2 |
2.2 |
0.891 |
5 |
3 |
0 |
0.000 |
Average: |
237.5 |
2.6 |
0.904 |
4 |
4 |
0 |
0.000 |
7 |
10 |
|
[GYF]B:402 |
7 |
1 |
275 |
f |
B |
x,y,z |
1_555 |
29 |
15 |
12364 |
184.8 |
-7.6 |
0.226 |
2 |
0 |
0 |
0.127 |
8 |
11 |
|
[GOL]C:402 |
6 |
1 |
218 |
f |
C |
x,y,z |
1_555 |
25 |
16 |
12338 |
156.7 |
-2.0 |
0.349 |
2 |
0 |
0 |
0.068 |
9 |
12 |
|
[GOL]A:403 |
6 |
1 |
214 |
f |
A |
x,y,z |
1_555 |
23 |
16 |
12625 |
149.6 |
-1.9 |
0.395 |
4 |
0 |
0 |
0.200 |
10 |
13 |
|
[EDO]D:404 |
4 |
1 |
186 |
◊ |
D |
x,y,z |
1_555 |
21 |
10 |
12799 |
109.7 |
2.9 |
0.478 |
2 |
0 |
0 |
0.000 |
11 |
14 |
|
[EDO]D:402 |
4 |
1 |
184 |
◊ |
D |
x,y,z |
1_555 |
15 |
8 |
12799 |
98.9 |
3.3 |
0.320 |
5 |
0 |
0 |
0.000 |
12 |
15 |
|
[EDO]D:403 |
4 |
1 |
183 |
◊ |
D |
x,y,z |
1_555 |
17 |
5 |
12799 |
92.6 |
2.7 |
0.502 |
2 |
0 |
0 |
0.000 |
13 |
16 |
|
[EDO]B:401 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
13 |
5 |
12364 |
91.6 |
2.8 |
0.324 |
2 |
0 |
0 |
0.000 |
14 |
17 |
|
[EDO]A:405 |
4 |
1 |
185 |
◊ |
D |
x-1,y,z |
1_455 |
12 |
4 |
12799 |
76.0 |
2.7 |
0.310 |
2 |
0 |
0 |
0.000 |
15 |
18 |
|
[EDO]A:405 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
11 |
3 |
12625 |
71.5 |
2.3 |
0.877 |
2 |
0 |
0 |
0.000 |
16 |
19 |
|
[CL]C:401 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
10 |
9 |
12338 |
67.8 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.292 |
17 |
20 |
|
B |
9 |
5 |
12364 |
x |
B |
x-1,y,z |
1_455 |
7 |
3 |
12364 |
67.1 |
-0.3 |
0.586 |
0 |
0 |
0 |
0.000 |
21 |
|
D |
6 |
5 |
12799 |
x |
D |
x-1,y,z |
1_455 |
5 |
2 |
12799 |
62.5 |
-0.3 |
0.515 |
0 |
0 |
0 |
0.000 |
Average: |
64.8 |
-0.3 |
0.551 |
0 |
0 |
0 |
0.000 |
18 |
22 |
|
B |
8 |
4 |
12364 |
f |
[EDO]A:404 |
x,y,z-1 |
1_554 |
4 |
1 |
184 |
65.9 |
2.2 |
0.331 |
2 |
0 |
0 |
0.000 |
19 |
23 |
|
[NA]C:403 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
10 |
6 |
12338 |
65.5 |
-11.5 |
0.000 |
0 |
0 |
0 |
0.271 |
20 |
24 |
|
[CL]D:401 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
7 |
4 |
12799 |
60.2 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.190 |
21 |
25 |
|
D |
5 |
3 |
12799 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
12364 |
59.5 |
1.4 |
0.889 |
2 |
3 |
0 |
0.000 |
26 |
|
B |
5 |
2 |
12364 |
◊ |
D |
x-1,y,z |
1_455 |
6 |
2 |
12799 |
55.0 |
1.2 |
0.885 |
2 |
3 |
0 |
0.000 |
Average: |
57.3 |
1.3 |
0.887 |
2 |
3 |
0 |
0.000 |
22 |
27 |
|
B |
7 |
3 |
12364 |
◊ |
A |
x,y,z-1 |
1_554 |
7 |
2 |
12625 |
54.2 |
0.1 |
0.549 |
0 |
0 |
0 |
0.002 |
28 |
|
D |
7 |
2 |
12799 |
◊ |
C |
x-1,y,z+1 |
1_456 |
3 |
2 |
12338 |
50.9 |
0.5 |
0.634 |
2 |
0 |
0 |
0.002 |
Average: |
52.6 |
0.3 |
0.591 |
1 |
0 |
0 |
0.002 |
23 |
29 |
|
[CL]A:401 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
11 |
5 |
12625 |
51.4 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.269 |
30 |
|
[CL]A:401 |
1 |
1 |
125 |
◊ |
C |
x-1,y,z+1 |
1_456 |
9 |
5 |
12338 |
50.8 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.269 |
Average: |
51.1 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.269 |
24 |
31 |
|
[EDO]A:404 |
3 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
7 |
4 |
12625 |
50.6 |
1.9 |
0.305 |
0 |
0 |
0 |
0.000 |
25 |
32 |
|
[EDO]D:404 |
3 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
12625 |
45.9 |
0.9 |
0.759 |
1 |
0 |
0 |
0.000 |
26 |
33 |
|
B |
10 |
4 |
12364 |
f |
[CL]A:402 |
x,y,z-1 |
1_554 |
1 |
1 |
125 |
42.8 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.074 |
27 |
34 |
|
[CL]A:402 |
1 |
1 |
125 |
◊ |
C |
x-1,y,z+1 |
1_456 |
9 |
3 |
12338 |
39.3 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.065 |
28 |
35 |
|
[EDO]B:401 |
2 |
1 |
185 |
f |
C |
x-1,y,z |
1_455 |
4 |
1 |
12338 |
30.8 |
0.2 |
0.584 |
0 |
0 |
0 |
0.000 |
29 |
36 |
|
[EDO]A:404 |
3 |
1 |
184 |
f |
[CL]A:402 |
x,y,z |
1_555 |
1 |
1 |
125 |
27.4 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.033 |
30 |
37 |
|
A |
4 |
1 |
12625 |
◊ |
[CL]D:401 |
x,y-1,z |
1_545 |
1 |
1 |
125 |
27.1 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.005 |
31 |
38 |
|
[EDO]A:404 |
3 |
1 |
184 |
◊ |
C |
x-1,y,z+1 |
1_456 |
5 |
2 |
12338 |
26.9 |
0.3 |
0.739 |
0 |
0 |
0 |
0.000 |
32 |
39 |
|
[EDO]D:403 |
4 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
12364 |
22.1 |
1.0 |
0.970 |
0 |
0 |
0 |
0.000 |
33 |
40 |
|
B |
5 |
4 |
12364 |
◊ |
C |
x-1,y-1,z |
1_445 |
5 |
3 |
12338 |
21.2 |
0.1 |
0.645 |
0 |
0 |
0 |
0.000 |
34 |
41 |
|
[EDO]D:402 |
2 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
3 |
1 |
12364 |
17.2 |
0.7 |
0.876 |
0 |
0 |
0 |
0.000 |
35 |
42 |
|
[CL]A:402 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
12625 |
11.5 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.008 |
36 |
43 |
|
[NA]C:403 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
12799 |
9.8 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.000 |
37 |
44 |
|
B |
1 |
1 |
12364 |
◊ |
C |
x,y-1,z |
1_545 |
1 |
1 |
12338 |
9.1 |
0.5 |
0.905 |
0 |
0 |
0 |
0.000 |
38 |
45 |
|
[EDO]D:403 |
1 |
1 |
183 |
f |
C |
x,y,z |
1_555 |
1 |
1 |
12338 |
0.5 |
0.0 |
0.842 |
0 |
0 |
0 |
0.000 |
|