## |
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 |
|
B |
181 |
50 |
12823 |
◊ |
A |
x,y,z |
1_555 |
187 |
52 |
12450 |
1734.3 |
-17.0 |
0.079 |
12 |
4 |
0 |
1.000 |
2 |
|
D |
167 |
47 |
12736 |
◊ |
C |
x,y,z |
1_555 |
182 |
51 |
12721 |
1653.6 |
-15.0 |
0.093 |
14 |
4 |
0 |
1.000 |
Average: |
1694.0 |
-16.0 |
0.086 |
13 |
4 |
0 |
1.000 |
2 |
3 |
|
H |
85 |
18 |
4126 |
◊ |
G |
x,y,z |
1_555 |
85 |
18 |
4128 |
824.3 |
-5.1 |
0.871 |
40 |
0 |
0 |
1.000 |
4 |
|
F |
86 |
18 |
4091 |
◊ |
E |
x,y,z |
1_555 |
88 |
18 |
4098 |
824.1 |
-6.7 |
0.846 |
39 |
0 |
0 |
1.000 |
Average: |
824.2 |
-5.9 |
0.859 |
40 |
0 |
0 |
1.000 |
3 |
5 |
|
A |
64 |
17 |
12450 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
65 |
21 |
12823 |
556.6 |
2.9 |
0.779 |
2 |
6 |
0 |
0.000 |
4 |
6 |
|
B |
42 |
14 |
12823 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
50 |
14 |
12450 |
480.4 |
-1.2 |
0.493 |
4 |
1 |
0 |
0.000 |
5 |
7 |
|
D |
49 |
12 |
12736 |
◊ |
A |
-x+3/2,-y+1,z-1/2 |
2_664 |
45 |
11 |
12450 |
398.8 |
-0.6 |
0.550 |
6 |
1 |
0 |
0.000 |
8 |
|
B |
48 |
11 |
12823 |
◊ |
C |
x,y,z |
1_555 |
43 |
10 |
12721 |
387.0 |
-0.5 |
0.568 |
4 |
1 |
0 |
0.000 |
Average: |
392.9 |
-0.5 |
0.559 |
5 |
1 |
0 |
0.000 |
6 |
9 |
|
H |
37 |
6 |
4126 |
◊ |
D |
x,y,z |
1_555 |
42 |
13 |
12736 |
342.5 |
-11.1 |
0.194 |
4 |
0 |
0 |
1.000 |
10 |
|
F |
37 |
6 |
4091 |
◊ |
B |
x,y,z |
1_555 |
40 |
13 |
12823 |
327.7 |
-10.2 |
0.227 |
3 |
0 |
0 |
1.000 |
Average: |
335.1 |
-10.6 |
0.211 |
4 |
0 |
0 |
1.000 |
7 |
11 |
|
G |
34 |
6 |
4128 |
◊ |
C |
x,y,z |
1_555 |
38 |
14 |
12721 |
333.7 |
-9.7 |
0.237 |
4 |
0 |
0 |
1.000 |
12 |
|
E |
34 |
6 |
4098 |
◊ |
A |
x,y,z |
1_555 |
38 |
12 |
12450 |
331.1 |
-9.5 |
0.256 |
4 |
0 |
0 |
1.000 |
Average: |
332.4 |
-9.6 |
0.246 |
4 |
0 |
0 |
1.000 |
8 |
13 |
|
E |
38 |
7 |
4098 |
◊ |
B |
x,y,z |
1_555 |
31 |
10 |
12823 |
301.5 |
-3.6 |
0.609 |
7 |
0 |
0 |
0.234 |
14 |
|
G |
38 |
7 |
4128 |
◊ |
D |
x,y,z |
1_555 |
31 |
10 |
12736 |
300.3 |
-3.5 |
0.613 |
6 |
0 |
0 |
0.234 |
Average: |
300.9 |
-3.6 |
0.611 |
7 |
0 |
0 |
0.234 |
9 |
15 |
|
B |
37 |
10 |
12823 |
x |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
35 |
10 |
12823 |
300.3 |
-3.3 |
0.240 |
4 |
4 |
0 |
0.000 |
10 |
16 |
|
H |
30 |
5 |
4126 |
◊ |
C |
x,y,z |
1_555 |
23 |
7 |
12721 |
241.9 |
-2.1 |
0.620 |
6 |
0 |
0 |
0.172 |
17 |
|
F |
29 |
5 |
4091 |
◊ |
A |
x,y,z |
1_555 |
22 |
7 |
12450 |
231.7 |
-2.4 |
0.589 |
5 |
0 |
0 |
0.172 |
Average: |
236.8 |
-2.2 |
0.604 |
6 |
0 |
0 |
0.172 |
11 |
18 |
|
[OOA]A:1236 |
10 |
1 |
339 |
f |
A |
x,y,z |
1_555 |
41 |
16 |
12450 |
205.0 |
6.6 |
0.350 |
0 |
0 |
0 |
0.000 |
12 |
19 |
|
[OOA]C:1236 |
10 |
1 |
338 |
f |
C |
x,y,z |
1_555 |
42 |
16 |
12721 |
204.3 |
6.5 |
0.369 |
1 |
0 |
0 |
0.000 |
13 |
20 |
|
[OOA]D:1236 |
10 |
1 |
333 |
f |
D |
x,y,z |
1_555 |
37 |
17 |
12736 |
201.6 |
6.4 |
0.398 |
1 |
0 |
0 |
0.000 |
14 |
21 |
|
[OOA]B:1236 |
10 |
1 |
335 |
f |
B |
x,y,z |
1_555 |
37 |
17 |
12823 |
200.6 |
6.5 |
0.393 |
1 |
0 |
0 |
0.000 |
15 |
22 |
|
H |
22 |
5 |
4126 |
◊ |
C |
-x+2,y-1/2,-z+1/2 |
3_745 |
24 |
8 |
12721 |
194.4 |
-6.2 |
0.278 |
0 |
0 |
0 |
0.000 |
16 |
23 |
|
B |
27 |
10 |
12823 |
◊ |
D |
-x+2,y-1/2,-z+1/2 |
3_745 |
24 |
7 |
12736 |
189.0 |
1.3 |
0.738 |
3 |
2 |
0 |
0.000 |
17 |
24 |
|
H |
25 |
3 |
4126 |
◊ |
E |
x,y,z |
1_555 |
21 |
2 |
4098 |
137.3 |
2.3 |
0.871 |
0 |
0 |
0 |
0.000 |
25 |
|
G |
19 |
2 |
4128 |
◊ |
F |
-x+3/2,-y+1,z-1/2 |
2_664 |
23 |
3 |
4091 |
130.7 |
4.1 |
0.917 |
0 |
0 |
0 |
0.000 |
Average: |
134.0 |
3.2 |
0.894 |
0 |
0 |
0 |
0.000 |
18 |
26 |
|
[HSL]B:1235 |
7 |
1 |
239 |
f |
B |
x,y,z |
1_555 |
23 |
12 |
12823 |
125.9 |
-1.3 |
0.485 |
2 |
0 |
0 |
0.408 |
19 |
27 |
|
[HSL]D:1235 |
7 |
1 |
238 |
f |
D |
x,y,z |
1_555 |
25 |
13 |
12736 |
123.6 |
-1.3 |
0.458 |
2 |
0 |
0 |
0.308 |
20 |
28 |
|
[HSL]A:1235 |
7 |
1 |
238 |
f |
A |
x,y,z |
1_555 |
27 |
13 |
12450 |
122.0 |
-1.5 |
0.410 |
2 |
0 |
0 |
0.464 |
21 |
29 |
|
[HSL]C:1235 |
7 |
1 |
238 |
f |
C |
x,y,z |
1_555 |
26 |
12 |
12721 |
121.1 |
-1.5 |
0.404 |
2 |
0 |
0 |
0.424 |
22 |
30 |
|
C |
11 |
3 |
12721 |
◊ |
D |
x-1,y,z |
1_455 |
9 |
4 |
12736 |
91.0 |
-0.5 |
0.295 |
0 |
0 |
0 |
0.000 |
23 |
31 |
|
G |
13 |
1 |
4128 |
◊ |
E |
x,y,z |
1_555 |
11 |
1 |
4098 |
80.3 |
0.5 |
0.733 |
0 |
0 |
0 |
0.000 |
32 |
|
G |
9 |
1 |
4128 |
◊ |
E |
-x+3/2,-y+1,z-1/2 |
2_664 |
9 |
1 |
4098 |
56.6 |
-0.3 |
0.614 |
0 |
0 |
0 |
0.000 |
Average: |
68.5 |
0.1 |
0.673 |
0 |
0 |
0 |
0.000 |
24 |
33 |
|
D |
7 |
3 |
12736 |
x |
D |
x-1,y,z |
1_455 |
9 |
5 |
12736 |
78.8 |
2.7 |
0.908 |
1 |
2 |
0 |
0.000 |
25 |
34 |
|
G |
10 |
2 |
4128 |
◊ |
D |
-x+2,y-1/2,-z+1/2 |
3_745 |
8 |
2 |
12736 |
68.5 |
-1.0 |
0.550 |
0 |
0 |
0 |
0.000 |
26 |
35 |
|
G |
10 |
3 |
4128 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
6 |
2 |
12450 |
68.4 |
-2.4 |
0.436 |
1 |
0 |
0 |
0.000 |
27 |
36 |
|
H |
12 |
1 |
4126 |
◊ |
F |
x,y,z |
1_555 |
11 |
1 |
4091 |
62.5 |
0.7 |
0.710 |
0 |
0 |
0 |
0.000 |
37 |
|
H |
9 |
1 |
4126 |
◊ |
F |
-x+3/2,-y+1,z-1/2 |
2_664 |
11 |
1 |
4091 |
60.3 |
-0.1 |
0.604 |
0 |
0 |
0 |
0.000 |
Average: |
61.4 |
0.3 |
0.657 |
0 |
0 |
0 |
0.000 |
28 |
38 |
|
C |
7 |
1 |
12721 |
◊ |
A |
-x+3/2,-y+1,z-1/2 |
2_664 |
8 |
2 |
12450 |
56.8 |
0.7 |
0.711 |
1 |
0 |
0 |
0.000 |
39 |
|
C |
8 |
2 |
12721 |
◊ |
A |
x,y,z |
1_555 |
7 |
1 |
12450 |
55.9 |
0.5 |
0.691 |
1 |
0 |
0 |
0.000 |
Average: |
56.4 |
0.6 |
0.701 |
1 |
0 |
0 |
0.000 |
29 |
40 |
|
H |
11 |
2 |
4126 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
6 |
2 |
12450 |
56.2 |
0.7 |
0.729 |
0 |
0 |
0 |
0.000 |
30 |
41 |
|
[OOA]C:1236 |
6 |
1 |
338 |
cf |
[HSL]C:1235 |
x,y,z |
1_555 |
4 |
1 |
238 |
54.6 |
2.2 |
0.016 |
0 |
0 |
0 |
0.000 |
31 |
42 |
|
[OOA]D:1236 |
7 |
1 |
333 |
cf |
[HSL]D:1235 |
x,y,z |
1_555 |
5 |
1 |
238 |
54.1 |
2.0 |
0.003 |
0 |
0 |
0 |
0.000 |
32 |
43 |
|
[OOA]A:1236 |
6 |
1 |
339 |
cf |
[HSL]A:1235 |
x,y,z |
1_555 |
5 |
1 |
238 |
53.9 |
2.0 |
0.008 |
0 |
0 |
0 |
0.000 |
33 |
44 |
|
[OOA]B:1236 |
5 |
1 |
335 |
cf |
[HSL]B:1235 |
x,y,z |
1_555 |
4 |
1 |
239 |
52.1 |
2.2 |
0.065 |
0 |
0 |
0 |
0.000 |
34 |
45 |
|
G |
7 |
2 |
4128 |
◊ |
D |
x-1,y,z |
1_455 |
3 |
1 |
12736 |
30.7 |
-0.8 |
0.488 |
0 |
0 |
0 |
0.000 |
35 |
46 |
|
D |
5 |
2 |
12736 |
◊ |
A |
-x+5/2,-y+1,z-1/2 |
2_764 |
2 |
1 |
12450 |
30.1 |
0.8 |
0.835 |
0 |
0 |
0 |
0.000 |
36 |
47 |
|
G |
5 |
1 |
4128 |
◊ |
F |
x,y,z |
1_555 |
5 |
1 |
4091 |
27.8 |
-1.1 |
0.471 |
0 |
0 |
0 |
0.000 |
48 |
|
H |
3 |
1 |
4126 |
◊ |
E |
-x+3/2,-y+1,z-1/2 |
2_664 |
2 |
1 |
4098 |
8.6 |
-0.9 |
0.349 |
0 |
0 |
0 |
0.000 |
Average: |
18.2 |
-1.0 |
0.410 |
0 |
0 |
0 |
0.000 |
37 |
49 |
|
H |
5 |
2 |
4126 |
◊ |
D |
x-1,y,z |
1_455 |
2 |
1 |
12736 |
27.1 |
-1.5 |
0.224 |
0 |
0 |
0 |
0.000 |
38 |
50 |
|
D |
2 |
1 |
12736 |
◊ |
C |
-x+2,y-1/2,-z+1/2 |
3_745 |
2 |
1 |
12721 |
16.4 |
0.2 |
0.742 |
0 |
0 |
0 |
0.000 |
39 |
51 |
|
E |
3 |
2 |
4098 |
◊ |
C |
x-1/2,-y+3/2,-z+1 |
4_466 |
1 |
1 |
12721 |
10.7 |
-0.7 |
0.271 |
0 |
0 |
0 |
0.000 |
40 |
52 |
|
F |
1 |
1 |
4091 |
◊ |
C |
x-1,y,z |
1_455 |
2 |
1 |
12721 |
4.3 |
-0.2 |
0.357 |
0 |
0 |
0 |
0.000 |
41 |
53 |
|
A |
1 |
1 |
12450 |
◊ |
C |
x-1/2,-y+1/2,-z+1 |
4_456 |
1 |
1 |
12721 |
0.1 |
-0.0 |
0.650 |
0 |
0 |
0 |
0.000 |
42 |
54 |
|
E |
1 |
1 |
4098 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
1 |
1 |
12823 |
0.1 |
-0.0 |
0.473 |
0 |
0 |
0 |
0.000 |
|