## |
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 |
|
A |
32 |
11 |
9477 |
x |
A |
z-1/4,y+1/4,-x+1/4 |
21_455 |
40 |
16 |
9477 |
322.4 |
-1.1 |
0.687 |
5 |
0 |
0 |
0.000 |
2 |
2 |
|
A |
20 |
8 |
9477 |
x |
A |
z,x,y |
5_555 |
26 |
9 |
9477 |
222.4 |
-1.3 |
0.518 |
1 |
0 |
0 |
0.000 |
3 |
3 |
|
A |
24 |
9 |
9477 |
◊ |
A |
-x-1/4,-z-1/4,-y-1/4 |
19_444 |
21 |
9 |
9477 |
214.4 |
-2.1 |
0.425 |
2 |
0 |
0 |
0.000 |
4 |
4 |
|
A |
20 |
6 |
9477 |
◊ |
A |
-x+1/4,z-1/4,y+1/4 |
18_545 |
20 |
6 |
9477 |
179.2 |
-2.3 |
0.366 |
0 |
0 |
0 |
0.000 |
5 |
5 |
|
[NAG]A:302 |
10 |
1 |
364 |
cf |
A |
x,y,z |
1_555 |
16 |
6 |
9477 |
125.2 |
3.5 |
0.478 |
0 |
0 |
0 |
0.000 |
6 |
6 |
|
[NAG]A:303 |
9 |
1 |
358 |
cf |
A |
x,y,z |
1_555 |
9 |
4 |
9477 |
105.9 |
3.4 |
0.466 |
0 |
0 |
0 |
0.000 |
7 |
7 |
|
[NAG]A:304 |
11 |
1 |
361 |
cf |
A |
x,y,z |
1_555 |
12 |
4 |
9477 |
102.7 |
2.7 |
0.309 |
2 |
0 |
0 |
0.000 |
8 |
8 |
|
[XYP]A:314 |
9 |
1 |
269 |
f |
A |
x,y,z |
1_555 |
15 |
5 |
9477 |
101.0 |
-1.3 |
0.841 |
3 |
0 |
0 |
0.003 |
9 |
9 |
|
[XYP]A:316 |
7 |
1 |
259 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
9477 |
92.9 |
-3.0 |
0.601 |
1 |
0 |
0 |
0.003 |
10 |
10 |
|
[XYP]A:317 |
9 |
1 |
259 |
f |
A |
x,y,z |
1_555 |
17 |
6 |
9477 |
92.1 |
-2.1 |
0.762 |
2 |
0 |
0 |
0.003 |
11 |
11 |
|
[XYP]A:318 |
6 |
1 |
256 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
9477 |
79.7 |
-0.8 |
0.585 |
0 |
0 |
0 |
0.000 |
12 |
12 |
|
[CL]A:309 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
9477 |
67.2 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.009 |
13 |
13 |
|
[CL]A:310 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
9477 |
66.6 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.009 |
14 |
14 |
|
[XYP]A:318 |
7 |
1 |
256 |
◊ |
A |
z-1/4,y+1/4,-x+1/4 |
21_455 |
11 |
5 |
9477 |
65.6 |
0.1 |
0.760 |
0 |
0 |
0 |
0.000 |
15 |
15 |
|
[CL]A:308 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
9477 |
64.8 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.010 |
16 |
16 |
|
[NAG]A:304 |
7 |
1 |
361 |
f |
[NAG]A:303 |
x,y,z |
1_555 |
4 |
1 |
358 |
63.7 |
3.1 |
0.279 |
1 |
0 |
0 |
0.000 |
17 |
17 |
|
[CL]A:307 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
9477 |
63.5 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.010 |
18 |
18 |
|
[CL]A:306 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
9477 |
61.4 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.009 |
19 |
19 |
|
[CL]A:313 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
9477 |
55.0 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.007 |
20 |
20 |
|
[XYP]A:316 |
4 |
1 |
259 |
cf |
[XYP]A:315 |
x,y,z |
1_555 |
4 |
1 |
259 |
54.2 |
-1.3 |
0.745 |
0 |
0 |
0 |
0.001 |
21 |
21 |
|
[XYP]A:315 |
5 |
1 |
259 |
cf |
[XYP]A:314 |
x,y,z |
1_555 |
3 |
1 |
269 |
53.4 |
-1.1 |
0.778 |
0 |
0 |
0 |
0.001 |
22 |
22 |
|
[CL]A:311 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
9477 |
53.2 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.007 |
23 |
23 |
|
[CL]A:312 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
9477 |
52.3 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.006 |
24 |
24 |
|
[XYP]A:317 |
5 |
1 |
259 |
cf |
[XYP]A:316 |
x,y,z |
1_555 |
5 |
1 |
259 |
51.9 |
-1.7 |
0.756 |
0 |
0 |
0 |
0.003 |
25 |
|
[XYP]A:318 |
4 |
1 |
256 |
cf |
[XYP]A:317 |
x,y,z |
1_555 |
4 |
1 |
259 |
51.4 |
-1.6 |
0.730 |
0 |
0 |
0 |
0.003 |
Average: |
51.7 |
-1.6 |
0.743 |
0 |
0 |
0 |
0.003 |
25 |
26 |
|
[CL]A:305 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
9477 |
47.7 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.007 |
26 |
27 |
|
[CU]A:301 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
9477 |
44.6 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.008 |
27 |
28 |
|
[CL]A:311 |
1 |
1 |
125 |
◊ |
A |
z,x,y |
5_555 |
4 |
3 |
9477 |
44.5 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.000 |
28 |
29 |
|
[XYP]A:315 |
4 |
1 |
259 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
9477 |
44.2 |
0.3 |
0.696 |
0 |
0 |
0 |
0.000 |
29 |
30 |
|
[XYP]A:317 |
5 |
1 |
259 |
◊ |
A |
z-1/4,y+1/4,-x+1/4 |
21_455 |
7 |
4 |
9477 |
42.7 |
-1.7 |
0.599 |
0 |
0 |
0 |
0.000 |
30 |
31 |
|
[XYP]A:316 |
5 |
1 |
259 |
f |
[CL]A:305 |
x,y,z |
1_555 |
1 |
1 |
125 |
28.0 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.005 |
32 |
|
[XYP]A:315 |
3 |
1 |
259 |
f |
[CL]A:312 |
x,y,z |
1_555 |
1 |
1 |
125 |
25.6 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.005 |
Average: |
26.8 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.005 |
31 |
33 |
|
[XYP]A:314 |
4 |
1 |
269 |
f |
[CL]A:312 |
x,y,z |
1_555 |
1 |
1 |
125 |
26.6 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.003 |
34 |
|
[XYP]A:315 |
4 |
1 |
259 |
f |
[CL]A:305 |
x,y,z |
1_555 |
1 |
1 |
125 |
24.3 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.003 |
Average: |
25.5 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.003 |
32 |
35 |
|
A |
3 |
2 |
9477 |
◊ |
[CL]A:308 |
z-1/4,y+1/4,-x+1/4 |
21_455 |
1 |
1 |
125 |
19.2 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.000 |
33 |
36 |
|
[XYP]A:315 |
3 |
1 |
259 |
f |
[CU]A:301 |
x,y,z |
1_555 |
1 |
1 |
125 |
16.6 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.000 |
34 |
37 |
|
[CL]A:305 |
1 |
1 |
125 |
f |
[CU]A:301 |
x,y,z |
1_555 |
1 |
1 |
125 |
13.0 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.003 |
35 |
38 |
|
A |
2 |
1 |
9477 |
◊ |
[XYP]A:314 |
z,x,y |
5_555 |
1 |
1 |
269 |
11.4 |
-0.5 |
0.556 |
0 |
0 |
0 |
0.000 |
36 |
39 |
|
[XYP]A:317 |
2 |
1 |
259 |
◊ |
[CL]A:308 |
z-1/4,y+1/4,-x+1/4 |
21_455 |
1 |
1 |
125 |
9.6 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.000 |
37 |
40 |
|
[CL]A:312 |
1 |
1 |
125 |
f |
[CU]A:301 |
x,y,z |
1_555 |
1 |
1 |
125 |
9.5 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.002 |
38 |
41 |
|
[XYP]A:314 |
2 |
1 |
269 |
f |
[CU]A:301 |
x,y,z |
1_555 |
1 |
1 |
125 |
6.8 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.000 |
39 |
42 |
|
[XYP]A:316 |
2 |
1 |
259 |
f |
[CL]A:312 |
x,y,z |
1_555 |
1 |
1 |
125 |
4.2 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.000 |
40 |
43 |
|
A |
1 |
1 |
9477 |
◊ |
[CL]A:307 |
z-1/4,y+1/4,-x+1/4 |
21_455 |
1 |
1 |
125 |
3.5 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.000 |
41 |
44 |
|
[XYP]A:316 |
2 |
1 |
259 |
f |
[CU]A:301 |
x,y,z |
1_555 |
1 |
1 |
125 |
2.2 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.000 |
42 |
45 |
|
[XYP]A:315 |
1 |
1 |
259 |
◊ |
[NAG]A:303 |
z-1/4,y+1/4,-x+1/4 |
21_455 |
1 |
1 |
358 |
1.0 |
-0.0 |
0.333 |
0 |
0 |
0 |
0.000 |
|