## |
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 |
227 |
61 |
10943 |
◊ |
C |
x,y,z |
1_555 |
223 |
59 |
10947 |
2071.1 |
-20.2 |
0.241 |
34 |
6 |
0 |
0.521 |
2 |
|
B |
219 |
58 |
10914 |
◊ |
A |
x,y,z |
1_555 |
223 |
59 |
10972 |
2055.5 |
-20.5 |
0.203 |
33 |
6 |
0 |
0.521 |
Average: |
2063.3 |
-20.3 |
0.222 |
34 |
6 |
0 |
0.521 |
2 |
3 |
|
D |
39 |
12 |
10943 |
◊ |
A |
x,y,z |
1_555 |
32 |
8 |
10972 |
296.7 |
-2.9 |
0.414 |
1 |
0 |
0 |
0.000 |
3 |
4 |
|
C |
31 |
11 |
10947 |
◊ |
A |
x,y,z-1 |
1_554 |
34 |
10 |
10972 |
296.6 |
-3.3 |
0.312 |
2 |
2 |
0 |
0.000 |
4 |
5 |
|
D |
34 |
12 |
10943 |
◊ |
B |
x,y,z |
1_555 |
28 |
8 |
10914 |
268.5 |
-2.5 |
0.435 |
3 |
0 |
0 |
0.000 |
5 |
6 |
|
D |
26 |
8 |
10943 |
◊ |
A |
x,y-1,z |
1_545 |
21 |
5 |
10972 |
201.0 |
-0.5 |
0.628 |
2 |
2 |
0 |
0.000 |
6 |
7 |
|
C |
22 |
5 |
10947 |
◊ |
B |
x-1,y+1,z-1 |
1_464 |
21 |
7 |
10914 |
185.4 |
3.0 |
0.928 |
6 |
5 |
0 |
0.000 |
7 |
8 |
|
C |
22 |
5 |
10947 |
◊ |
A |
x,y,z |
1_555 |
19 |
7 |
10972 |
160.8 |
-0.8 |
0.573 |
1 |
1 |
0 |
0.000 |
8 |
9 |
|
[TRS]C:304 |
7 |
1 |
250 |
f |
C |
x,y,z |
1_555 |
35 |
15 |
10947 |
132.1 |
4.1 |
0.546 |
7 |
0 |
0 |
0.000 |
9 |
10 |
|
[TRS]B:304 |
7 |
1 |
256 |
f |
B |
x,y,z |
1_555 |
30 |
15 |
10914 |
131.5 |
4.1 |
0.674 |
7 |
0 |
0 |
0.000 |
11 |
|
[TRS]A:304 |
7 |
1 |
253 |
f |
A |
x,y,z |
1_555 |
32 |
15 |
10972 |
129.3 |
4.2 |
0.612 |
7 |
0 |
0 |
0.000 |
Average: |
130.4 |
4.2 |
0.643 |
7 |
0 |
0 |
0.000 |
10 |
12 |
|
[TRS]D:304 |
8 |
1 |
248 |
f |
D |
x,y,z |
1_555 |
31 |
14 |
10943 |
127.5 |
4.0 |
0.628 |
8 |
0 |
0 |
0.000 |
11 |
13 |
|
[POP]C:301 |
9 |
1 |
262 |
f |
C |
x,y,z |
1_555 |
24 |
9 |
10947 |
115.7 |
0.1 |
0.660 |
14 |
0 |
0 |
0.084 |
14 |
|
[POP]B:302 |
9 |
1 |
263 |
f |
B |
x,y,z |
1_555 |
21 |
9 |
10914 |
115.2 |
0.8 |
0.667 |
13 |
0 |
0 |
0.084 |
Average: |
115.5 |
0.4 |
0.663 |
14 |
0 |
0 |
0.084 |
12 |
15 |
|
[POP]D:301 |
9 |
1 |
263 |
f |
D |
x,y,z |
1_555 |
21 |
9 |
10943 |
115.4 |
0.1 |
0.661 |
14 |
0 |
0 |
0.084 |
13 |
16 |
|
[POP]A:302 |
9 |
1 |
263 |
f |
A |
x,y,z |
1_555 |
22 |
9 |
10972 |
112.7 |
0.5 |
0.660 |
13 |
0 |
0 |
0.076 |
14 |
17 |
|
[POP]B:301 |
9 |
1 |
265 |
f |
B |
x,y,z |
1_555 |
21 |
9 |
10914 |
110.2 |
1.7 |
0.659 |
9 |
0 |
0 |
0.033 |
15 |
18 |
|
[POP]C:302 |
9 |
1 |
260 |
f |
C |
x,y,z |
1_555 |
22 |
9 |
10947 |
108.1 |
1.4 |
0.652 |
9 |
0 |
0 |
0.036 |
16 |
19 |
|
[POP]A:301 |
9 |
1 |
262 |
◊ |
A |
x,y,z |
1_555 |
21 |
9 |
10972 |
107.8 |
2.7 |
0.789 |
8 |
0 |
0 |
0.013 |
17 |
20 |
|
[POP]D:302 |
9 |
1 |
262 |
f |
D |
x,y,z |
1_555 |
21 |
10 |
10943 |
106.9 |
1.4 |
0.596 |
7 |
0 |
0 |
0.023 |
18 |
21 |
|
D |
12 |
3 |
10943 |
◊ |
A |
x,y,z-1 |
1_554 |
15 |
4 |
10972 |
103.7 |
-0.5 |
0.536 |
1 |
0 |
0 |
0.000 |
19 |
22 |
|
B |
11 |
5 |
10914 |
◊ |
A |
x,y-1,z |
1_545 |
10 |
4 |
10972 |
99.7 |
-0.6 |
0.348 |
2 |
0 |
0 |
0.000 |
20 |
23 |
|
D |
14 |
5 |
10943 |
◊ |
C |
x,y-1,z |
1_545 |
11 |
4 |
10947 |
91.6 |
-0.4 |
0.584 |
1 |
1 |
0 |
0.000 |
21 |
24 |
|
A |
10 |
5 |
10972 |
x |
A |
x-1,y,z |
1_455 |
9 |
4 |
10972 |
81.5 |
-1.1 |
0.385 |
0 |
0 |
0 |
0.000 |
22 |
25 |
|
[POP]D:302 |
8 |
1 |
262 |
◊ |
C |
x,y,z |
1_555 |
14 |
4 |
10947 |
75.1 |
-0.1 |
0.554 |
4 |
0 |
0 |
0.026 |
23 |
26 |
|
[POP]B:301 |
8 |
1 |
265 |
◊ |
A |
x,y,z |
1_555 |
15 |
6 |
10972 |
73.6 |
0.2 |
0.650 |
3 |
0 |
0 |
0.016 |
24 |
27 |
|
[POP]C:302 |
8 |
1 |
260 |
◊ |
D |
x,y,z |
1_555 |
14 |
6 |
10943 |
73.6 |
0.7 |
0.692 |
4 |
0 |
0 |
0.015 |
25 |
28 |
|
[POP]A:301 |
8 |
1 |
262 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
10914 |
72.0 |
-1.2 |
0.433 |
3 |
0 |
0 |
0.037 |
26 |
29 |
|
C |
13 |
5 |
10947 |
◊ |
D |
x-1,y,z |
1_455 |
7 |
3 |
10943 |
69.5 |
-0.2 |
0.559 |
1 |
1 |
0 |
0.000 |
27 |
30 |
|
C |
7 |
4 |
10947 |
◊ |
A |
x-1,y,z |
1_455 |
6 |
2 |
10972 |
62.0 |
-0.0 |
0.578 |
1 |
0 |
0 |
0.000 |
28 |
31 |
|
[POP]B:302 |
7 |
1 |
263 |
◊ |
A |
x,y,z |
1_555 |
10 |
4 |
10972 |
59.3 |
0.7 |
0.710 |
1 |
0 |
0 |
0.004 |
32 |
|
[POP]C:301 |
7 |
1 |
262 |
◊ |
D |
x,y,z |
1_555 |
8 |
2 |
10943 |
55.9 |
0.2 |
0.677 |
1 |
0 |
0 |
0.004 |
Average: |
57.6 |
0.4 |
0.694 |
1 |
0 |
0 |
0.004 |
29 |
33 |
|
[POP]D:301 |
6 |
1 |
263 |
◊ |
C |
x,y,z |
1_555 |
8 |
2 |
10947 |
59.1 |
-0.3 |
0.623 |
1 |
0 |
0 |
0.011 |
30 |
34 |
|
[POP]A:302 |
7 |
1 |
263 |
◊ |
B |
x,y,z |
1_555 |
9 |
3 |
10914 |
58.5 |
0.5 |
0.713 |
1 |
0 |
0 |
0.000 |
31 |
35 |
|
C |
6 |
3 |
10947 |
◊ |
B |
x,y,z-1 |
1_554 |
6 |
2 |
10914 |
46.9 |
-0.1 |
0.586 |
0 |
0 |
0 |
0.000 |
32 |
36 |
|
D |
11 |
4 |
10943 |
x |
D |
x-1,y,z |
1_455 |
3 |
1 |
10943 |
43.4 |
0.1 |
0.662 |
0 |
0 |
0 |
0.000 |
33 |
37 |
|
D |
4 |
3 |
10943 |
◊ |
B |
x,y,z-1 |
1_554 |
4 |
3 |
10914 |
33.7 |
-0.0 |
0.534 |
0 |
0 |
0 |
0.000 |
34 |
38 |
|
[TRS]A:304 |
4 |
1 |
253 |
f |
[POP]A:302 |
x,y,z |
1_555 |
4 |
1 |
263 |
31.5 |
1.1 |
0.793 |
1 |
0 |
0 |
0.000 |
35 |
39 |
|
[TRS]B:304 |
4 |
1 |
256 |
f |
[POP]B:302 |
x,y,z |
1_555 |
4 |
1 |
263 |
30.8 |
0.1 |
0.620 |
1 |
0 |
0 |
0.006 |
36 |
40 |
|
C |
7 |
3 |
10947 |
◊ |
A |
x-1,y,z-1 |
1_454 |
2 |
1 |
10972 |
30.6 |
0.9 |
0.829 |
1 |
0 |
0 |
0.000 |
37 |
41 |
|
[TRS]C:304 |
4 |
1 |
250 |
f |
[POP]C:301 |
x,y,z |
1_555 |
4 |
1 |
262 |
30.4 |
0.3 |
0.658 |
1 |
0 |
0 |
0.002 |
38 |
42 |
|
[TRS]D:304 |
4 |
1 |
248 |
f |
[POP]D:301 |
x,y,z |
1_555 |
5 |
1 |
263 |
30.1 |
0.4 |
0.134 |
1 |
0 |
0 |
0.000 |
39 |
43 |
|
[MG]D:303 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
9 |
6 |
10943 |
28.9 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.072 |
44 |
|
[MG]B:303 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
5 |
10914 |
28.7 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.072 |
45 |
|
[MG]A:303 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
10972 |
28.0 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.072 |
46 |
|
[MG]C:303 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
8 |
5 |
10947 |
27.6 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.072 |
Average: |
28.3 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.072 |
40 |
47 |
|
B |
6 |
2 |
10914 |
◊ |
A |
x-1,y,z |
1_455 |
2 |
1 |
10972 |
27.1 |
-0.6 |
0.320 |
0 |
0 |
0 |
0.000 |
41 |
48 |
|
[TRS]A:304 |
3 |
1 |
253 |
◊ |
[POP]A:301 |
x,y,z |
1_555 |
4 |
1 |
262 |
26.8 |
1.0 |
0.776 |
1 |
0 |
0 |
0.000 |
42 |
49 |
|
[TRS]B:304 |
3 |
1 |
256 |
f |
[POP]B:301 |
x,y,z |
1_555 |
4 |
1 |
265 |
26.4 |
0.4 |
0.691 |
1 |
0 |
0 |
0.000 |
43 |
50 |
|
[TRS]C:304 |
3 |
1 |
250 |
f |
[POP]C:302 |
x,y,z |
1_555 |
4 |
1 |
260 |
26.3 |
0.1 |
0.646 |
1 |
0 |
0 |
0.005 |
44 |
51 |
|
[TRS]D:304 |
3 |
1 |
248 |
f |
[POP]D:302 |
x,y,z |
1_555 |
4 |
1 |
262 |
26.3 |
0.3 |
0.168 |
1 |
0 |
0 |
0.002 |
45 |
52 |
|
B |
3 |
2 |
10914 |
x |
B |
x-1,y,z |
1_455 |
2 |
1 |
10914 |
24.5 |
-0.3 |
0.353 |
0 |
0 |
0 |
0.000 |
46 |
53 |
|
[MG]C:303 |
1 |
1 |
98 |
f |
[POP]C:301 |
x,y,z |
1_555 |
4 |
1 |
262 |
22.7 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.041 |
54 |
|
[MG]B:303 |
1 |
1 |
98 |
f |
[POP]B:302 |
x,y,z |
1_555 |
5 |
1 |
263 |
22.5 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.041 |
Average: |
22.6 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.041 |
47 |
55 |
|
[MG]A:303 |
1 |
1 |
98 |
f |
[POP]A:302 |
x,y,z |
1_555 |
4 |
1 |
263 |
22.3 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.054 |
56 |
|
[MG]C:303 |
1 |
1 |
98 |
f |
[POP]C:302 |
x,y,z |
1_555 |
4 |
1 |
260 |
19.5 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.054 |
57 |
|
[MG]D:303 |
1 |
1 |
98 |
f |
[POP]D:302 |
x,y,z |
1_555 |
4 |
1 |
262 |
19.0 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.054 |
Average: |
20.3 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.054 |
48 |
58 |
|
[MG]D:303 |
1 |
1 |
98 |
f |
[POP]D:301 |
x,y,z |
1_555 |
3 |
1 |
263 |
22.1 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.034 |
49 |
59 |
|
C |
1 |
1 |
10947 |
◊ |
B |
x-1,y,z |
1_455 |
3 |
1 |
10914 |
20.8 |
-0.4 |
0.250 |
0 |
0 |
0 |
0.000 |
50 |
60 |
|
[MG]B:303 |
1 |
1 |
98 |
f |
[POP]B:301 |
x,y,z |
1_555 |
4 |
1 |
265 |
19.6 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.041 |
51 |
61 |
|
[MG]A:303 |
1 |
1 |
98 |
◊ |
[POP]A:301 |
x,y,z |
1_555 |
4 |
1 |
262 |
19.5 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.027 |
52 |
62 |
|
[MG]D:303 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
6 |
2 |
10947 |
19.5 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.028 |
63 |
|
[MG]A:303 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
10914 |
14.9 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.028 |
64 |
|
[MG]C:303 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
3 |
2 |
10943 |
14.2 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.028 |
65 |
|
[MG]B:303 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
10972 |
13.4 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.028 |
Average: |
15.5 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.028 |
53 |
66 |
|
[POP]A:302 |
3 |
1 |
263 |
◊ |
[POP]A:301 |
x,y,z |
1_555 |
4 |
1 |
262 |
18.9 |
0.2 |
0.515 |
0 |
0 |
0 |
0.000 |
54 |
67 |
|
[POP]B:302 |
3 |
1 |
263 |
f |
[POP]B:301 |
x,y,z |
1_555 |
4 |
1 |
265 |
17.8 |
-1.2 |
0.292 |
0 |
0 |
0 |
0.018 |
55 |
68 |
|
[POP]C:302 |
4 |
1 |
260 |
f |
[POP]C:301 |
x,y,z |
1_555 |
3 |
1 |
262 |
17.7 |
-0.2 |
0.486 |
0 |
0 |
0 |
0.002 |
56 |
69 |
|
[POP]D:302 |
4 |
1 |
262 |
f |
[POP]D:301 |
x,y,z |
1_555 |
3 |
1 |
263 |
16.9 |
0.4 |
0.571 |
0 |
0 |
0 |
0.000 |
57 |
70 |
|
[TRS]B:304 |
2 |
1 |
256 |
f |
[MG]B:303 |
x,y,z |
1_555 |
1 |
1 |
98 |
11.2 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.020 |
71 |
|
[TRS]A:304 |
2 |
1 |
253 |
f |
[MG]A:303 |
x,y,z |
1_555 |
1 |
1 |
98 |
11.0 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.020 |
Average: |
11.1 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.020 |
58 |
72 |
|
[TRS]C:304 |
2 |
1 |
250 |
f |
[MG]C:303 |
x,y,z |
1_555 |
1 |
1 |
98 |
10.9 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.017 |
73 |
|
[TRS]D:304 |
2 |
1 |
248 |
f |
[MG]D:303 |
x,y,z |
1_555 |
1 |
1 |
98 |
9.6 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.017 |
Average: |
10.3 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.017 |
59 |
74 |
|
D |
2 |
1 |
10943 |
◊ |
A |
x-1,y-1,z |
1_445 |
1 |
1 |
10972 |
10.0 |
0.2 |
0.776 |
0 |
0 |
0 |
0.000 |
60 |
75 |
|
D |
1 |
1 |
10943 |
◊ |
B |
x-1,y,z-1 |
1_454 |
1 |
1 |
10914 |
1.8 |
0.1 |
0.768 |
0 |
0 |
0 |
0.000 |
|