## |
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 |
|
C |
284 |
76 |
22845 |
◊ |
A |
x,y,z |
1_555 |
295 |
78 |
22944 |
2899.5 |
-38.1 |
0.012 |
28 |
13 |
0 |
0.166 |
2 |
|
D |
289 |
74 |
22752 |
◊ |
B |
x,y,z |
1_555 |
292 |
75 |
21502 |
2854.1 |
-36.8 |
0.027 |
23 |
14 |
0 |
0.166 |
Average: |
2876.8 |
-37.4 |
0.019 |
26 |
14 |
0 |
0.166 |
2 |
3 |
|
B |
149 |
39 |
21502 |
◊ |
A |
x,y,z |
1_555 |
145 |
37 |
22944 |
1510.8 |
-7.3 |
0.529 |
19 |
11 |
0 |
0.065 |
4 |
|
D |
150 |
39 |
22752 |
◊ |
C |
x,y,z |
1_555 |
148 |
37 |
22845 |
1492.8 |
-7.5 |
0.480 |
21 |
10 |
0 |
0.065 |
Average: |
1501.8 |
-7.4 |
0.504 |
20 |
11 |
0 |
0.065 |
3 |
5 |
|
B |
78 |
24 |
21502 |
◊ |
C |
-x,y-1/2,-z+1 |
2_546 |
68 |
22 |
22845 |
594.2 |
1.8 |
0.836 |
2 |
3 |
0 |
0.000 |
4 |
6 |
|
D |
54 |
17 |
22752 |
◊ |
C |
x,y,z-1 |
1_554 |
48 |
16 |
22845 |
438.4 |
-1.9 |
0.563 |
2 |
5 |
0 |
0.000 |
5 |
7 |
|
C |
53 |
17 |
22845 |
◊ |
A |
x-1,y,z |
1_455 |
47 |
16 |
22944 |
437.2 |
-2.8 |
0.450 |
2 |
2 |
0 |
0.000 |
6 |
8 |
|
B |
39 |
11 |
21502 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
38 |
12 |
22845 |
363.7 |
4.0 |
0.922 |
0 |
6 |
0 |
0.000 |
7 |
9 |
|
[FBP]D:1574 |
20 |
1 |
484 |
f |
D |
x,y,z |
1_555 |
51 |
20 |
22752 |
327.9 |
-4.6 |
0.707 |
16 |
0 |
0 |
0.086 |
10 |
|
[FBP]B:1574 |
20 |
1 |
481 |
f |
B |
x,y,z |
1_555 |
49 |
19 |
21502 |
326.3 |
-4.6 |
0.706 |
17 |
0 |
0 |
0.086 |
11 |
|
[FBP]A:1574 |
20 |
1 |
479 |
f |
A |
x,y,z |
1_555 |
46 |
19 |
22944 |
325.3 |
-4.7 |
0.710 |
17 |
0 |
0 |
0.086 |
12 |
|
[FBP]C:1574 |
20 |
1 |
479 |
f |
C |
x,y,z |
1_555 |
49 |
19 |
22845 |
324.5 |
-4.8 |
0.703 |
16 |
0 |
0 |
0.086 |
Average: |
326.0 |
-4.7 |
0.706 |
17 |
0 |
0 |
0.086 |
8 |
13 |
|
D |
30 |
12 |
22752 |
◊ |
A |
x,y,z-1 |
1_554 |
28 |
11 |
22944 |
276.2 |
-0.7 |
0.601 |
0 |
0 |
0 |
0.000 |
9 |
14 |
|
B |
31 |
10 |
21502 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
28 |
8 |
22752 |
271.7 |
-3.7 |
0.275 |
0 |
0 |
0 |
0.000 |
10 |
15 |
|
D |
29 |
10 |
22752 |
◊ |
A |
x-1,y,z-1 |
1_454 |
35 |
11 |
22944 |
270.1 |
0.1 |
0.677 |
5 |
1 |
0 |
0.000 |
11 |
16 |
|
B |
36 |
8 |
21502 |
◊ |
A |
x-1,y,z |
1_455 |
31 |
8 |
22944 |
247.8 |
-1.8 |
0.429 |
0 |
1 |
0 |
0.000 |
12 |
17 |
|
D |
31 |
10 |
22752 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
29 |
7 |
22845 |
243.9 |
-2.9 |
0.363 |
1 |
2 |
0 |
0.000 |
13 |
18 |
|
D |
33 |
11 |
22752 |
◊ |
A |
x-1,y,z |
1_455 |
26 |
11 |
22944 |
226.5 |
0.2 |
0.686 |
1 |
0 |
0 |
0.000 |
14 |
19 |
|
[PGA]D:1575 |
9 |
1 |
273 |
f |
D |
x,y,z |
1_555 |
27 |
16 |
22752 |
158.2 |
-1.7 |
0.785 |
5 |
0 |
0 |
0.025 |
20 |
|
[PGA]A:1575 |
9 |
1 |
273 |
f |
A |
x,y,z |
1_555 |
27 |
18 |
22944 |
152.3 |
-1.6 |
0.792 |
5 |
0 |
0 |
0.025 |
21 |
|
[PGA]C:1575 |
9 |
1 |
273 |
f |
C |
x,y,z |
1_555 |
24 |
17 |
22845 |
151.3 |
-1.6 |
0.779 |
3 |
0 |
0 |
0.025 |
22 |
|
[PGA]B:1575 |
9 |
1 |
271 |
f |
B |
x,y,z |
1_555 |
25 |
17 |
21502 |
145.1 |
-1.4 |
0.811 |
4 |
0 |
0 |
0.025 |
Average: |
151.7 |
-1.6 |
0.792 |
4 |
0 |
0 |
0.025 |
15 |
23 |
|
[K]B:1576 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
15 |
11 |
21502 |
103.3 |
-82.1 |
0.000 |
0 |
0 |
0 |
0.589 |
24 |
|
[K]D:1576 |
1 |
1 |
216 |
f |
D |
x,y,z |
1_555 |
17 |
12 |
22752 |
101.9 |
-84.2 |
0.000 |
0 |
0 |
0 |
0.589 |
25 |
|
[K]C:1576 |
1 |
1 |
216 |
f |
C |
x,y,z |
1_555 |
15 |
12 |
22845 |
101.9 |
-81.7 |
0.000 |
0 |
0 |
0 |
0.589 |
26 |
|
[K]A:1576 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
14 |
11 |
22944 |
99.8 |
-80.4 |
0.000 |
0 |
0 |
0 |
0.589 |
Average: |
101.7 |
-82.1 |
0.000 |
0 |
0 |
0 |
0.589 |
16 |
27 |
|
B |
7 |
4 |
21502 |
x |
B |
x-1,y,z |
1_455 |
6 |
4 |
21502 |
53.4 |
-0.3 |
0.442 |
0 |
0 |
0 |
0.000 |
17 |
28 |
|
[MN]D:1577 |
1 |
1 |
123 |
cf |
D |
x,y,z |
1_555 |
9 |
7 |
22752 |
44.9 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.020 |
29 |
|
[MN]C:1577 |
1 |
1 |
123 |
cf |
C |
x,y,z |
1_555 |
10 |
8 |
22845 |
44.6 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.020 |
30 |
|
[MN]A:1577 |
1 |
1 |
123 |
cf |
A |
x,y,z |
1_555 |
12 |
8 |
22944 |
43.6 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.020 |
31 |
|
[MN]B:1577 |
1 |
1 |
123 |
cf |
B |
x,y,z |
1_555 |
11 |
7 |
21502 |
43.6 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.020 |
Average: |
44.2 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.020 |
18 |
32 |
|
[K]C:1576 |
1 |
1 |
216 |
f |
[PGA]C:1575 |
x,y,z |
1_555 |
4 |
1 |
273 |
42.7 |
-21.7 |
0.000 |
0 |
0 |
0 |
0.152 |
33 |
|
[K]B:1576 |
1 |
1 |
216 |
f |
[PGA]B:1575 |
x,y,z |
1_555 |
4 |
1 |
271 |
42.2 |
-21.7 |
0.000 |
0 |
0 |
0 |
0.152 |
34 |
|
[K]A:1576 |
1 |
1 |
216 |
f |
[PGA]A:1575 |
x,y,z |
1_555 |
4 |
1 |
273 |
41.1 |
-21.4 |
0.000 |
0 |
0 |
0 |
0.152 |
35 |
|
[K]D:1576 |
1 |
1 |
216 |
f |
[PGA]D:1575 |
x,y,z |
1_555 |
4 |
1 |
273 |
35.5 |
-18.4 |
0.000 |
0 |
0 |
0 |
0.152 |
Average: |
40.4 |
-20.8 |
0.000 |
0 |
0 |
0 |
0.152 |
19 |
36 |
|
[MN]B:1577 |
1 |
1 |
123 |
f |
[PGA]B:1575 |
x,y,z |
1_555 |
5 |
1 |
271 |
41.1 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.023 |
37 |
|
[MN]C:1577 |
1 |
1 |
123 |
cf |
[PGA]C:1575 |
x,y,z |
1_555 |
4 |
1 |
273 |
39.6 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.023 |
38 |
|
[MN]A:1577 |
1 |
1 |
123 |
f |
[PGA]A:1575 |
x,y,z |
1_555 |
5 |
1 |
273 |
39.5 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.023 |
39 |
|
[MN]D:1577 |
1 |
1 |
123 |
f |
[PGA]D:1575 |
x,y,z |
1_555 |
6 |
1 |
273 |
39.5 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.023 |
Average: |
39.9 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.023 |
20 |
40 |
|
D |
4 |
2 |
22752 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
22944 |
26.0 |
0.2 |
0.703 |
0 |
0 |
0 |
0.000 |
41 |
|
C |
4 |
1 |
22845 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
21502 |
23.0 |
-0.3 |
0.482 |
0 |
0 |
0 |
0.000 |
Average: |
24.5 |
-0.1 |
0.593 |
0 |
0 |
0 |
0.000 |
21 |
42 |
|
[MN]A:1577 |
1 |
1 |
123 |
f |
[K]A:1576 |
x,y,z |
1_555 |
1 |
1 |
216 |
15.5 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.032 |
22 |
43 |
|
D |
5 |
2 |
22752 |
◊ |
B |
x,y,z-1 |
1_554 |
3 |
1 |
21502 |
13.9 |
0.0 |
0.639 |
0 |
0 |
0 |
0.000 |
23 |
44 |
|
[MN]D:1577 |
1 |
1 |
123 |
f |
[K]D:1576 |
x,y,z |
1_555 |
1 |
1 |
216 |
13.2 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.027 |
24 |
45 |
|
[MN]C:1577 |
1 |
1 |
123 |
f |
[K]C:1576 |
x,y,z |
1_555 |
1 |
1 |
216 |
12.0 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.025 |
25 |
46 |
|
[MN]B:1577 |
1 |
1 |
123 |
f |
[K]B:1576 |
x,y,z |
1_555 |
1 |
1 |
216 |
11.7 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.024 |
26 |
47 |
|
[FBP]C:1574 |
1 |
1 |
479 |
◊ |
A |
x-1,y,z |
1_455 |
1 |
1 |
22944 |
6.8 |
-0.0 |
0.347 |
0 |
0 |
0 |
0.000 |
|