## |
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 |
98 |
27 |
13629 |
◊ |
A |
x,y,z |
1_555 |
99 |
29 |
13691 |
922.7 |
-0.8 |
0.765 |
10 |
7 |
0 |
0.023 |
2 |
2 |
|
B |
32 |
10 |
13629 |
◊ |
A |
x-1,y,z |
1_455 |
29 |
9 |
13691 |
355.7 |
-7.0 |
0.046 |
6 |
0 |
0 |
0.038 |
3 |
3 |
|
B |
37 |
9 |
13629 |
◊ |
A |
-x,y-1/2,-z+1 |
2_546 |
37 |
9 |
13691 |
350.8 |
-3.8 |
0.312 |
3 |
0 |
0 |
0.000 |
4 |
4 |
|
A |
44 |
13 |
13691 |
x |
A |
-x,y-1/2,-z |
2_545 |
37 |
11 |
13691 |
348.4 |
1.2 |
0.786 |
6 |
2 |
0 |
0.000 |
5 |
5 |
|
B |
34 |
14 |
13629 |
x |
B |
-x,y-1/2,-z+1 |
2_546 |
33 |
10 |
13629 |
321.4 |
-2.1 |
0.276 |
5 |
0 |
0 |
0.000 |
6 |
6 |
|
B |
6 |
3 |
13629 |
◊ |
A |
x,y-1,z |
1_545 |
10 |
4 |
13691 |
64.7 |
0.9 |
0.769 |
1 |
0 |
0 |
0.000 |
7 |
7 |
|
[NI]A:1558 |
1 |
1 |
115 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
13691 |
61.6 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.059 |
8 |
|
[NI]A:1555 |
1 |
1 |
115 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
13629 |
58.7 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.059 |
Average: |
60.2 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.059 |
8 |
9 |
|
[NA]B:1563 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
13629 |
59.2 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.057 |
10 |
|
[NA]A:1567 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
13691 |
54.9 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.057 |
Average: |
57.1 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.057 |
9 |
11 |
|
[MG]B:1558 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
13629 |
56.2 |
-8.5 |
0.000 |
0 |
0 |
0 |
0.070 |
12 |
|
[MG]A:1565 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
13691 |
52.2 |
-9.3 |
0.000 |
0 |
0 |
0 |
0.070 |
Average: |
54.2 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.070 |
10 |
13 |
|
[CD]A:1553 |
1 |
1 |
112 |
f |
A |
x,y,z |
1_555 |
11 |
8 |
13691 |
55.7 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.059 |
14 |
|
[CD]B:1556 |
1 |
1 |
112 |
f |
B |
x,y,z |
1_555 |
7 |
6 |
13629 |
49.6 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.059 |
Average: |
52.6 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.059 |
11 |
15 |
|
[NA]A:1566 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
5 |
5 |
13691 |
54.8 |
-10.3 |
0.000 |
0 |
0 |
0 |
0.080 |
16 |
|
[NA]B:1562 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
5 |
5 |
13629 |
54.3 |
-10.0 |
0.000 |
0 |
0 |
0 |
0.080 |
Average: |
54.6 |
-10.2 |
0.000 |
0 |
0 |
0 |
0.080 |
12 |
17 |
|
[NI]A:1563 |
1 |
1 |
115 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
13691 |
52.1 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.043 |
18 |
|
[NI]B:1561 |
1 |
1 |
115 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
13629 |
47.4 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.043 |
Average: |
49.7 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.043 |
13 |
19 |
|
[NI]A:1561 |
1 |
1 |
115 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
13691 |
50.6 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.054 |
20 |
|
[NI]B:1559 |
1 |
1 |
115 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
13629 |
50.5 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.054 |
Average: |
50.5 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.054 |
14 |
21 |
|
[ZN]A:1552 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
13691 |
50.1 |
-33.4 |
0.000 |
0 |
0 |
0 |
0.264 |
22 |
|
[ZN]B:1553 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
4 |
13629 |
49.6 |
-33.5 |
0.000 |
0 |
0 |
0 |
0.264 |
Average: |
49.9 |
-33.5 |
0.000 |
0 |
0 |
0 |
0.264 |
15 |
23 |
|
[NI]B:1555 |
1 |
1 |
115 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
13691 |
49.7 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.038 |
24 |
|
[NI]A:1562 |
1 |
1 |
115 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
13629 |
48.4 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.038 |
Average: |
49.0 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.038 |
16 |
25 |
|
[NI]A:1556 |
1 |
1 |
115 |
f |
B |
x,y,z |
1_555 |
6 |
3 |
13629 |
48.4 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.023 |
17 |
26 |
|
[CD]B:1554 |
1 |
1 |
112 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
13691 |
48.0 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.018 |
18 |
27 |
|
[NI]A:1562 |
1 |
1 |
115 |
f |
A |
x,y,z |
1_555 |
7 |
2 |
13691 |
46.9 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.042 |
28 |
|
[NI]B:1555 |
1 |
1 |
115 |
f |
B |
x,y,z |
1_555 |
5 |
2 |
13629 |
45.8 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.042 |
Average: |
46.4 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.042 |
19 |
29 |
|
[NI]A:1556 |
1 |
1 |
115 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
13691 |
45.7 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.017 |
20 |
30 |
|
[NI]B:1560 |
1 |
1 |
115 |
f |
B |
x,y,z |
1_555 |
6 |
2 |
13629 |
45.1 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.024 |
21 |
31 |
|
[CD]B:1554 |
1 |
1 |
112 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
13629 |
43.7 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.013 |
22 |
32 |
|
[CD]A:1554 |
1 |
1 |
112 |
f |
A |
x,y,z |
1_555 |
10 |
3 |
13691 |
43.4 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.015 |
23 |
33 |
|
[MG]A:1560 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
13691 |
43.4 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.019 |
24 |
34 |
|
B |
5 |
1 |
13629 |
f |
[NI]A:1564 |
x-1,y,z |
1_455 |
1 |
1 |
115 |
42.0 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.020 |
25 |
35 |
|
[NI]A:1559 |
1 |
1 |
115 |
f |
A |
x,y,z |
1_555 |
5 |
2 |
13691 |
40.1 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.017 |
26 |
36 |
|
[NI]A:1564 |
1 |
1 |
115 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
13691 |
39.8 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.019 |
27 |
37 |
|
[NI]A:1555 |
1 |
1 |
115 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
13691 |
36.6 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.026 |
38 |
|
[NI]A:1558 |
1 |
1 |
115 |
◊ |
B |
x,y,z |
1_555 |
5 |
1 |
13629 |
28.9 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.026 |
Average: |
32.8 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.026 |
28 |
39 |
|
[CD]A:1554 |
1 |
1 |
112 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
6 |
2 |
13691 |
35.9 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.000 |
29 |
40 |
|
[NA]B:1563 |
1 |
1 |
125 |
f |
[NA]B:1562 |
x,y,z |
1_555 |
1 |
1 |
125 |
26.8 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.021 |
30 |
41 |
|
[NA]A:1567 |
1 |
1 |
125 |
f |
[NA]A:1566 |
x,y,z |
1_555 |
1 |
1 |
125 |
23.3 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.018 |
31 |
42 |
|
[NI]A:1559 |
1 |
1 |
115 |
f |
[CD]A:1554 |
x,y,z |
1_555 |
1 |
1 |
112 |
19.2 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.014 |
32 |
43 |
|
[NI]A:1557 |
1 |
1 |
115 |
f |
[CD]A:1553 |
x,y,z |
1_555 |
1 |
1 |
112 |
18.1 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.013 |
33 |
44 |
|
[NI]B:1557 |
1 |
1 |
115 |
f |
[CD]B:1556 |
x,y,z |
1_555 |
1 |
1 |
112 |
17.6 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.013 |
34 |
45 |
|
[NI]A:1559 |
1 |
1 |
115 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
3 |
2 |
13691 |
15.1 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
35 |
46 |
|
[NI]A:1562 |
1 |
1 |
115 |
◊ |
[NI]A:1555 |
x,y,z |
1_555 |
1 |
1 |
115 |
6.5 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.005 |
36 |
47 |
|
[NI]B:1555 |
1 |
1 |
115 |
◊ |
[NI]A:1558 |
x,y,z |
1_555 |
1 |
1 |
115 |
6.2 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.005 |
37 |
48 |
|
[NI]A:1563 |
1 |
1 |
115 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
13629 |
5.3 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.003 |
49 |
|
[NI]B:1561 |
1 |
1 |
115 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
13691 |
5.0 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.003 |
Average: |
5.2 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.003 |
|