## |
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 |
53 |
10 |
8024 |
x |
D |
-x+1,y-1/2,-z-1 |
2_644 |
50 |
12 |
8024 |
443.5 |
-3.1 |
0.326 |
3 |
2 |
0 |
0.000 |
2 |
|
B |
49 |
12 |
8062 |
x |
B |
-x,y-1/2,-z |
2_545 |
55 |
9 |
8062 |
433.3 |
-4.0 |
0.247 |
2 |
2 |
0 |
0.000 |
3 |
|
A |
54 |
11 |
8056 |
x |
A |
-x+1,y-1/2,-z |
2_645 |
45 |
11 |
8056 |
426.9 |
-3.3 |
0.322 |
0 |
2 |
0 |
0.000 |
4 |
|
C |
45 |
11 |
8015 |
x |
C |
-x,y-1/2,-z-1 |
2_544 |
52 |
10 |
8015 |
400.7 |
-3.9 |
0.276 |
0 |
2 |
0 |
0.000 |
Average: |
426.1 |
-3.6 |
0.293 |
1 |
2 |
0 |
0.000 |
2 |
5 |
|
B |
55 |
18 |
8062 |
◊ |
A |
x,y,z |
1_555 |
50 |
14 |
8056 |
431.6 |
-1.5 |
0.415 |
4 |
4 |
0 |
0.000 |
6 |
|
D |
52 |
19 |
8024 |
◊ |
C |
x,y,z |
1_555 |
50 |
14 |
8015 |
419.4 |
-1.9 |
0.381 |
5 |
3 |
0 |
0.000 |
Average: |
425.5 |
-1.7 |
0.398 |
5 |
4 |
0 |
0.000 |
3 |
7 |
|
A |
37 |
16 |
8056 |
◊ |
B |
-x+1,y-1/2,-z |
2_645 |
31 |
11 |
8062 |
317.1 |
0.1 |
0.569 |
3 |
0 |
0 |
0.000 |
8 |
|
D |
27 |
9 |
8024 |
◊ |
C |
-x,y-1/2,-z-1 |
2_544 |
38 |
14 |
8015 |
306.2 |
-1.2 |
0.467 |
3 |
0 |
0 |
0.000 |
Average: |
311.7 |
-0.6 |
0.518 |
3 |
0 |
0 |
0.000 |
4 |
9 |
|
C |
32 |
13 |
8015 |
◊ |
B |
x,y,z |
1_555 |
30 |
12 |
8062 |
242.2 |
1.0 |
0.619 |
4 |
2 |
0 |
0.000 |
5 |
10 |
|
D |
22 |
9 |
8024 |
◊ |
A |
x,y,z-1 |
1_554 |
22 |
9 |
8056 |
170.4 |
1.0 |
0.676 |
2 |
2 |
0 |
0.000 |
6 |
11 |
|
D |
17 |
6 |
8024 |
◊ |
C |
x,y-1,z |
1_545 |
22 |
10 |
8015 |
159.6 |
1.0 |
0.685 |
1 |
0 |
0 |
0.000 |
12 |
|
A |
22 |
11 |
8056 |
◊ |
B |
x,y-1,z |
1_545 |
15 |
5 |
8062 |
150.2 |
2.1 |
0.777 |
2 |
0 |
0 |
0.000 |
Average: |
154.9 |
1.5 |
0.731 |
2 |
0 |
0 |
0.000 |
7 |
13 |
|
A |
16 |
5 |
8056 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
12 |
3 |
8062 |
139.9 |
-1.4 |
0.333 |
2 |
0 |
0 |
0.000 |
14 |
|
D |
12 |
3 |
8024 |
◊ |
C |
-x+1,y-1/2,-z-1 |
2_644 |
18 |
6 |
8015 |
139.1 |
-1.4 |
0.356 |
1 |
0 |
0 |
0.000 |
Average: |
139.5 |
-1.4 |
0.345 |
2 |
0 |
0 |
0.000 |
8 |
15 |
|
[GOL]D:203 |
6 |
1 |
218 |
f |
D |
x,y,z |
1_555 |
15 |
7 |
8024 |
116.3 |
0.3 |
0.591 |
4 |
0 |
0 |
0.015 |
9 |
16 |
|
[GOL]C:203 |
6 |
1 |
218 |
◊ |
C |
x,y,z |
1_555 |
12 |
6 |
8015 |
93.6 |
0.5 |
0.635 |
3 |
0 |
0 |
0.000 |
10 |
17 |
|
[GOL]B:203 |
6 |
1 |
221 |
f |
B |
x,y,z |
1_555 |
16 |
5 |
8062 |
86.0 |
-0.6 |
0.484 |
2 |
0 |
0 |
0.007 |
11 |
18 |
|
[GOL]B:203 |
6 |
1 |
221 |
◊ |
C |
x,y,z |
1_555 |
15 |
5 |
8015 |
79.3 |
-0.2 |
0.512 |
1 |
0 |
0 |
0.000 |
12 |
19 |
|
[GOL]C:203 |
4 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
13 |
3 |
8062 |
78.7 |
-1.0 |
0.360 |
1 |
0 |
0 |
0.007 |
13 |
20 |
|
[CL]B:201 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
8062 |
65.9 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.085 |
21 |
|
[CL]D:201 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
13 |
6 |
8024 |
64.5 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.085 |
Average: |
65.2 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.085 |
14 |
22 |
|
[CL]C:202 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
11 |
6 |
8015 |
63.7 |
-8.2 |
0.000 |
0 |
0 |
0 |
0.037 |
15 |
23 |
|
[CL]A:201 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
8056 |
62.5 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.100 |
24 |
|
[CL]C:201 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
12 |
5 |
8015 |
56.3 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.100 |
Average: |
59.4 |
-8.2 |
0.000 |
0 |
0 |
0 |
0.100 |
16 |
25 |
|
[CL]D:202 |
1 |
1 |
125 |
f |
C |
-x,y-1/2,-z-1 |
2_544 |
10 |
5 |
8015 |
59.6 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.029 |
17 |
26 |
|
[CL]B:202 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
8062 |
55.5 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.035 |
18 |
27 |
|
[GOL]D:203 |
4 |
1 |
218 |
◊ |
C |
x,y-1,z |
1_545 |
6 |
2 |
8015 |
34.9 |
-0.4 |
0.449 |
0 |
0 |
0 |
0.000 |
19 |
28 |
|
[CL]D:201 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
6 |
2 |
8015 |
33.5 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.000 |
29 |
|
[CL]B:201 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
8056 |
29.7 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
31.6 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.000 |
20 |
30 |
|
[CL]B:202 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
8015 |
32.0 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.000 |
21 |
31 |
|
[CL]A:201 |
1 |
1 |
125 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
6 |
3 |
8056 |
31.3 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.000 |
32 |
|
C |
6 |
3 |
8015 |
◊ |
[CL]C:201 |
-x,y-1/2,-z-1 |
2_544 |
1 |
1 |
125 |
28.4 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
29.8 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.000 |
22 |
33 |
|
[CL]D:202 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
8024 |
30.5 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.000 |
23 |
34 |
|
[CL]D:202 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
8015 |
25.7 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.000 |
24 |
35 |
|
D |
2 |
1 |
8024 |
◊ |
[CL]C:201 |
x,y-1,z |
1_545 |
1 |
1 |
125 |
21.9 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.000 |
36 |
|
[CL]A:201 |
1 |
1 |
125 |
◊ |
B |
x,y-1,z |
1_545 |
1 |
1 |
8062 |
6.9 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
14.4 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.000 |
25 |
37 |
|
[GOL]B:203 |
2 |
1 |
221 |
f |
[CL]B:202 |
x,y,z |
1_555 |
1 |
1 |
125 |
17.4 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.009 |
26 |
38 |
|
[GOL]C:203 |
1 |
1 |
218 |
f |
[GOL]B:203 |
x,y,z |
1_555 |
1 |
1 |
221 |
5.3 |
0.1 |
0.500 |
0 |
0 |
0 |
0.000 |
|