## |
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 |
217 |
53 |
13451 |
◊ |
C |
x,y,z |
1_555 |
223 |
53 |
13570 |
2106.4 |
-17.1 |
0.554 |
28 |
2 |
0 |
0.414 |
2 |
|
F |
215 |
52 |
13428 |
◊ |
E |
x,y,z |
1_555 |
217 |
53 |
13404 |
2106.1 |
-15.7 |
0.582 |
28 |
3 |
0 |
0.414 |
3 |
|
B |
218 |
53 |
13363 |
◊ |
A |
x,y,z |
1_555 |
220 |
53 |
13343 |
2097.9 |
-17.0 |
0.522 |
28 |
2 |
0 |
0.414 |
Average: |
2103.4 |
-16.6 |
0.553 |
28 |
2 |
0 |
0.414 |
2 |
4 |
|
C |
104 |
31 |
13570 |
◊ |
A |
x,y,z |
1_555 |
93 |
25 |
13343 |
911.8 |
-11.6 |
0.250 |
7 |
4 |
0 |
0.425 |
5 |
|
F |
94 |
25 |
13428 |
◊ |
D |
x,y,z |
1_555 |
102 |
31 |
13451 |
910.6 |
-11.7 |
0.243 |
7 |
4 |
0 |
0.425 |
6 |
|
E |
93 |
24 |
13404 |
◊ |
A |
x,y,z |
1_555 |
102 |
31 |
13343 |
908.8 |
-11.8 |
0.225 |
7 |
4 |
0 |
0.425 |
7 |
|
D |
94 |
25 |
13451 |
◊ |
B |
x,y,z |
1_555 |
103 |
31 |
13363 |
908.8 |
-12.1 |
0.226 |
8 |
4 |
0 |
0.425 |
8 |
|
E |
101 |
31 |
13404 |
◊ |
C |
x,y,z |
1_555 |
93 |
25 |
13570 |
906.5 |
-11.5 |
0.264 |
7 |
4 |
0 |
0.425 |
9 |
|
F |
102 |
31 |
13428 |
◊ |
B |
x,y,z |
1_555 |
92 |
24 |
13363 |
905.8 |
-11.9 |
0.219 |
7 |
4 |
0 |
0.425 |
Average: |
908.7 |
-11.8 |
0.238 |
7 |
4 |
0 |
0.425 |
3 |
10 |
|
E |
77 |
22 |
13404 |
◊ |
B |
x,y,z |
1_555 |
77 |
22 |
13363 |
727.2 |
-5.0 |
0.564 |
7 |
0 |
0 |
0.074 |
11 |
|
F |
77 |
22 |
13428 |
◊ |
C |
x,y,z |
1_555 |
78 |
22 |
13570 |
725.3 |
-5.0 |
0.585 |
9 |
0 |
0 |
0.074 |
12 |
|
D |
76 |
22 |
13451 |
◊ |
A |
x,y,z |
1_555 |
77 |
21 |
13343 |
724.0 |
-4.9 |
0.580 |
7 |
0 |
0 |
0.074 |
Average: |
725.5 |
-5.0 |
0.576 |
8 |
0 |
0 |
0.074 |
4 |
13 |
|
D |
43 |
18 |
13451 |
◊ |
D |
-x+1,-y+3/2,z |
6_665 |
43 |
18 |
13451 |
333.9 |
-10.1 |
0.050 |
0 |
0 |
0 |
0.065 |
5 |
14 |
|
C |
37 |
12 |
13570 |
◊ |
B |
-x+1,-y+3/2,z |
6_665 |
33 |
11 |
13363 |
268.5 |
-3.8 |
0.404 |
1 |
0 |
0 |
0.012 |
6 |
15 |
|
C |
24 |
9 |
13570 |
◊ |
C |
-x+3/2,y,-z |
7_655 |
24 |
9 |
13570 |
235.0 |
-2.9 |
0.396 |
6 |
0 |
0 |
0.008 |
7 |
16 |
|
F |
29 |
12 |
13428 |
◊ |
F |
-x+3/2,y,-z |
7_655 |
29 |
12 |
13428 |
234.1 |
-7.5 |
0.057 |
0 |
0 |
0 |
0.011 |
8 |
17 |
|
B |
20 |
8 |
13363 |
◊ |
B |
x,-y+1,-z+1/2 |
8_565 |
20 |
8 |
13363 |
208.1 |
-7.0 |
0.023 |
0 |
0 |
0 |
0.001 |
9 |
18 |
|
D |
22 |
7 |
13451 |
◊ |
C |
-x+3/2,y,-z |
7_655 |
21 |
7 |
13570 |
199.7 |
-3.9 |
0.161 |
1 |
0 |
0 |
0.012 |
10 |
19 |
|
E |
25 |
11 |
13404 |
◊ |
D |
-x+3/2,y,-z |
7_655 |
20 |
7 |
13451 |
162.8 |
-1.1 |
0.595 |
0 |
0 |
0 |
0.003 |
11 |
20 |
|
F |
21 |
6 |
13428 |
◊ |
A |
x,-y+1,-z+1/2 |
8_565 |
17 |
6 |
13343 |
157.9 |
-2.9 |
0.270 |
0 |
0 |
0 |
0.000 |
12 |
21 |
|
[GOL]C:301 |
6 |
1 |
213 |
f |
C |
x,y,z |
1_555 |
22 |
11 |
13570 |
143.1 |
-1.8 |
0.444 |
3 |
0 |
0 |
0.059 |
22 |
|
[GOL]E:301 |
6 |
1 |
214 |
f |
E |
x,y,z |
1_555 |
22 |
12 |
13404 |
140.5 |
-1.8 |
0.437 |
4 |
0 |
0 |
0.059 |
Average: |
141.8 |
-1.8 |
0.441 |
4 |
0 |
0 |
0.059 |
13 |
23 |
|
[GOL]D:301 |
6 |
1 |
215 |
f |
D |
x,y,z |
1_555 |
23 |
12 |
13451 |
142.9 |
-1.1 |
0.499 |
2 |
0 |
0 |
0.088 |
24 |
|
[GOL]B:301 |
6 |
1 |
215 |
f |
B |
x,y,z |
1_555 |
22 |
11 |
13363 |
142.7 |
-1.7 |
0.403 |
3 |
0 |
0 |
0.088 |
25 |
|
[GOL]A:301 |
6 |
1 |
215 |
f |
A |
x,y,z |
1_555 |
22 |
12 |
13343 |
141.8 |
-1.6 |
0.459 |
4 |
0 |
0 |
0.088 |
Average: |
142.5 |
-1.4 |
0.453 |
3 |
0 |
0 |
0.088 |
14 |
26 |
|
[GOL]F:301 |
6 |
1 |
216 |
f |
F |
x,y,z |
1_555 |
22 |
11 |
13428 |
142.7 |
-1.0 |
0.498 |
3 |
0 |
0 |
0.030 |
15 |
27 |
|
A |
9 |
3 |
13343 |
◊ |
A |
-x+1,-y+3/2,z |
6_665 |
9 |
3 |
13343 |
73.1 |
-1.8 |
0.270 |
0 |
0 |
0 |
0.003 |
16 |
28 |
|
E |
9 |
4 |
13404 |
◊ |
E |
x,-y+1,-z+1/2 |
8_565 |
9 |
4 |
13404 |
70.9 |
-2.3 |
0.183 |
0 |
0 |
0 |
0.000 |
17 |
29 |
|
[SO4]D:403 |
4 |
1 |
187 |
f |
D |
x,y,z |
1_555 |
6 |
3 |
13451 |
65.3 |
-6.9 |
0.932 |
2 |
0 |
0 |
0.108 |
18 |
30 |
|
[CL]E:402 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
8 |
4 |
13404 |
61.2 |
-8.0 |
0.000 |
0 |
0 |
0 |
0.216 |
31 |
|
[CL]D:402 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
9 |
4 |
13451 |
60.5 |
-7.9 |
0.000 |
0 |
0 |
0 |
0.216 |
32 |
|
[CL]A:402 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
13343 |
60.1 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.216 |
33 |
|
[CL]F:402 |
1 |
1 |
125 |
f |
F |
x,y,z |
1_555 |
8 |
4 |
13428 |
59.6 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.216 |
34 |
|
[CL]C:402 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
10 |
4 |
13570 |
58.9 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.216 |
Average: |
60.1 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.216 |
19 |
35 |
|
[CL]D:401 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
10 |
4 |
13451 |
52.9 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.193 |
36 |
|
[CL]C:401 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
10 |
4 |
13570 |
52.9 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.193 |
37 |
|
[CL]A:401 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
13343 |
52.4 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.193 |
38 |
|
[CL]B:401 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
9 |
3 |
13363 |
52.4 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.193 |
39 |
|
[CL]E:401 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
10 |
4 |
13404 |
51.4 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.193 |
40 |
|
[CL]F:401 |
1 |
1 |
125 |
f |
F |
x,y,z |
1_555 |
10 |
4 |
13428 |
51.1 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.193 |
Average: |
52.2 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.193 |
20 |
41 |
|
[CL]E:403 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
9 |
4 |
13404 |
52.3 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.090 |
21 |
42 |
|
[CL]A:403 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
13343 |
48.7 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.173 |
43 |
|
[CL]F:403 |
1 |
1 |
125 |
f |
F |
x,y,z |
1_555 |
9 |
4 |
13428 |
47.8 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.173 |
44 |
|
[CL]B:402 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
13363 |
46.5 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.173 |
Average: |
47.6 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.173 |
22 |
45 |
|
[SO4]D:403 |
4 |
1 |
187 |
◊ |
E |
-x+3/2,y,-z |
7_655 |
3 |
1 |
13404 |
26.3 |
-2.6 |
0.912 |
0 |
0 |
0 |
0.007 |
23 |
46 |
|
[CL]F:403 |
1 |
1 |
125 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
13404 |
12.6 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.028 |
47 |
|
[CL]B:402 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
13343 |
12.2 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.028 |
48 |
|
[CL]A:403 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
13363 |
11.3 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.028 |
Average: |
12.0 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.028 |
24 |
49 |
|
[CL]D:402 |
1 |
1 |
125 |
◊ |
D |
-x+1,-y+3/2,z |
6_665 |
2 |
1 |
13451 |
3.7 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.004 |
|