## |
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 |
|
E |
148 |
32 |
15639 |
◊ |
A |
x,y,z |
1_555 |
155 |
34 |
16662 |
1425.4 |
-16.0 |
0.070 |
12 |
2 |
0 |
0.188 |
2 |
|
F |
148 |
35 |
15710 |
◊ |
D |
x,y,z |
1_555 |
148 |
33 |
16459 |
1372.5 |
-14.6 |
0.110 |
12 |
4 |
0 |
0.188 |
Average: |
1398.9 |
-15.3 |
0.090 |
12 |
3 |
0 |
0.188 |
2 |
3 |
|
C |
140 |
32 |
16281 |
◊ |
B |
x,y,z |
1_555 |
150 |
34 |
16353 |
1395.8 |
-13.8 |
0.131 |
16 |
10 |
0 |
0.202 |
3 |
4 |
|
A |
87 |
24 |
16662 |
◊ |
C |
x,y-1,z-1 |
1_544 |
89 |
26 |
16281 |
863.5 |
-6.0 |
0.290 |
7 |
4 |
0 |
0.000 |
5 |
|
B |
92 |
26 |
16353 |
◊ |
D |
x,y-1,z |
1_545 |
86 |
24 |
16459 |
840.0 |
-5.4 |
0.350 |
6 |
4 |
0 |
0.000 |
Average: |
851.7 |
-5.7 |
0.320 |
7 |
4 |
0 |
0.000 |
4 |
6 |
|
B |
65 |
20 |
16353 |
◊ |
A |
x-1,y,z |
1_455 |
71 |
23 |
16662 |
649.4 |
-2.0 |
0.498 |
6 |
1 |
0 |
0.000 |
7 |
|
D |
67 |
23 |
16459 |
◊ |
C |
x,y,z-1 |
1_554 |
67 |
20 |
16281 |
606.3 |
-3.4 |
0.426 |
5 |
0 |
0 |
0.000 |
Average: |
627.9 |
-2.7 |
0.462 |
6 |
1 |
0 |
0.000 |
5 |
8 |
|
D |
52 |
16 |
16459 |
◊ |
E |
x-1,y,z |
1_455 |
57 |
19 |
15639 |
475.4 |
-6.1 |
0.187 |
3 |
0 |
0 |
0.000 |
9 |
|
F |
49 |
17 |
15710 |
◊ |
A |
x,y,z |
1_555 |
54 |
18 |
16662 |
449.0 |
-4.7 |
0.090 |
1 |
0 |
0 |
0.000 |
Average: |
462.2 |
-5.4 |
0.138 |
2 |
0 |
0 |
0.000 |
6 |
10 |
|
B |
54 |
13 |
16353 |
◊ |
E |
x-1,y-1,z-1 |
1_444 |
60 |
15 |
15639 |
466.9 |
0.6 |
0.697 |
8 |
2 |
0 |
0.000 |
11 |
|
F |
59 |
15 |
15710 |
◊ |
C |
x-1,y-1,z-2 |
1_443 |
54 |
15 |
16281 |
454.9 |
1.1 |
0.744 |
9 |
2 |
0 |
0.000 |
12 |
|
A |
53 |
15 |
16662 |
◊ |
D |
x,y-1,z-1 |
1_544 |
48 |
14 |
16459 |
439.8 |
0.4 |
0.659 |
7 |
2 |
0 |
0.000 |
Average: |
453.9 |
0.7 |
0.700 |
8 |
2 |
0 |
0.000 |
7 |
13 |
|
[87R]B:2003 |
26 |
1 |
579 |
f |
B |
x,y,z |
1_555 |
58 |
21 |
16353 |
414.5 |
5.1 |
0.333 |
0 |
0 |
0 |
0.000 |
14 |
|
[87R]A:2004 |
26 |
1 |
576 |
f |
A |
x,y,z |
1_555 |
58 |
21 |
16662 |
412.0 |
5.4 |
0.343 |
1 |
0 |
0 |
0.000 |
15 |
|
[87R]D:2004 |
26 |
1 |
578 |
f |
D |
x,y,z |
1_555 |
55 |
21 |
16459 |
410.9 |
5.5 |
0.364 |
1 |
0 |
0 |
0.000 |
16 |
|
[87R]C:2003 |
26 |
1 |
577 |
f |
C |
x,y,z |
1_555 |
56 |
20 |
16281 |
408.4 |
5.3 |
0.346 |
0 |
0 |
0 |
0.000 |
17 |
|
[87R]E:2003 |
26 |
1 |
577 |
f |
E |
x,y,z |
1_555 |
54 |
21 |
15639 |
408.0 |
5.4 |
0.357 |
2 |
0 |
0 |
0.000 |
18 |
|
[87R]F:2003 |
26 |
1 |
579 |
f |
F |
x,y,z |
1_555 |
58 |
21 |
15710 |
406.5 |
5.4 |
0.385 |
1 |
0 |
0 |
0.000 |
Average: |
410.1 |
5.3 |
0.355 |
1 |
0 |
0 |
0.000 |
8 |
19 |
|
E |
42 |
13 |
15639 |
◊ |
D |
x,y,z |
1_555 |
41 |
10 |
16459 |
350.1 |
-3.0 |
0.365 |
3 |
1 |
0 |
0.000 |
20 |
|
F |
41 |
14 |
15710 |
◊ |
A |
x-1,y,z |
1_455 |
41 |
10 |
16662 |
328.8 |
-2.2 |
0.411 |
4 |
1 |
0 |
0.000 |
Average: |
339.5 |
-2.6 |
0.388 |
4 |
1 |
0 |
0.000 |
9 |
21 |
|
F |
40 |
11 |
15710 |
◊ |
B |
x,y,z-1 |
1_554 |
33 |
10 |
16353 |
296.1 |
-0.8 |
0.573 |
2 |
0 |
0 |
0.000 |
22 |
|
C |
33 |
12 |
16281 |
◊ |
E |
x-1,y,z |
1_455 |
44 |
11 |
15639 |
292.3 |
-0.4 |
0.614 |
4 |
0 |
0 |
0.000 |
Average: |
294.2 |
-0.6 |
0.593 |
3 |
0 |
0 |
0.000 |
10 |
23 |
|
F |
30 |
10 |
15710 |
◊ |
E |
x-1,y-1,z-1 |
1_444 |
33 |
12 |
15639 |
277.8 |
4.0 |
0.915 |
4 |
6 |
0 |
0.000 |
11 |
24 |
|
D |
33 |
13 |
16459 |
◊ |
C |
x,y,z |
1_555 |
23 |
8 |
16281 |
247.4 |
1.8 |
0.791 |
6 |
1 |
0 |
0.000 |
25 |
|
A |
29 |
12 |
16662 |
◊ |
B |
x,y,z-1 |
1_554 |
28 |
10 |
16353 |
245.4 |
1.7 |
0.777 |
2 |
3 |
0 |
0.000 |
Average: |
246.4 |
1.7 |
0.784 |
4 |
2 |
0 |
0.000 |
12 |
26 |
|
F |
16 |
5 |
15710 |
◊ |
B |
x,y,z |
1_555 |
18 |
7 |
16353 |
169.6 |
2.1 |
0.824 |
2 |
3 |
0 |
0.000 |
27 |
|
E |
14 |
5 |
15639 |
◊ |
C |
x,y,z-1 |
1_554 |
13 |
5 |
16281 |
131.5 |
0.6 |
0.700 |
0 |
1 |
0 |
0.000 |
Average: |
150.6 |
1.4 |
0.762 |
1 |
2 |
0 |
0.000 |
13 |
28 |
|
F |
27 |
9 |
15710 |
◊ |
A |
x-1,y,z-1 |
1_454 |
19 |
7 |
16662 |
167.8 |
1.3 |
0.754 |
0 |
0 |
0 |
0.000 |
29 |
|
D |
19 |
7 |
16459 |
◊ |
E |
x-1,y,z-1 |
1_454 |
25 |
10 |
15639 |
145.2 |
1.4 |
0.762 |
2 |
2 |
0 |
0.000 |
Average: |
156.5 |
1.3 |
0.758 |
1 |
1 |
0 |
0.000 |
14 |
30 |
|
F |
24 |
11 |
15710 |
◊ |
B |
x-1,y,z-1 |
1_454 |
16 |
8 |
16353 |
143.7 |
-0.7 |
0.495 |
0 |
0 |
0 |
0.000 |
31 |
|
E |
11 |
6 |
15639 |
◊ |
C |
x,y,z |
1_555 |
5 |
3 |
16281 |
59.5 |
0.4 |
0.718 |
1 |
0 |
0 |
0.000 |
Average: |
101.6 |
-0.1 |
0.606 |
1 |
0 |
0 |
0.000 |
15 |
32 |
|
B |
10 |
3 |
16353 |
◊ |
C |
x-1,y-1,z-1 |
1_444 |
9 |
4 |
16281 |
99.4 |
0.3 |
0.469 |
0 |
0 |
0 |
0.000 |
33 |
|
B |
12 |
5 |
16353 |
◊ |
C |
x,y-1,z-1 |
1_544 |
10 |
3 |
16281 |
91.4 |
1.1 |
0.737 |
0 |
0 |
0 |
0.000 |
Average: |
95.4 |
0.7 |
0.603 |
0 |
0 |
0 |
0.000 |
16 |
34 |
|
D |
13 |
4 |
16459 |
◊ |
C |
x-1,y,z-1 |
1_454 |
7 |
3 |
16281 |
85.6 |
1.5 |
0.807 |
0 |
0 |
0 |
0.000 |
35 |
|
B |
9 |
5 |
16353 |
◊ |
A |
x,y,z |
1_555 |
13 |
5 |
16662 |
85.1 |
0.9 |
0.741 |
0 |
0 |
0 |
0.000 |
Average: |
85.3 |
1.2 |
0.774 |
0 |
0 |
0 |
0.000 |
17 |
36 |
|
[MG]D:2001 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
14 |
8 |
16459 |
56.5 |
-8.2 |
0.000 |
0 |
0 |
0 |
0.148 |
37 |
|
[MG]A:2001 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
14 |
9 |
16662 |
56.3 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.148 |
38 |
|
[MG]B:2001 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
14 |
9 |
16353 |
55.6 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.148 |
39 |
|
[MG]C:2001 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
15 |
8 |
16281 |
55.3 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.148 |
40 |
|
[MG]E:2001 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
13 |
7 |
15639 |
55.2 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.148 |
41 |
|
[MG]F:2001 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
13 |
8 |
15710 |
54.3 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.148 |
Average: |
55.5 |
-7.9 |
0.000 |
0 |
0 |
0 |
0.148 |
18 |
42 |
|
D |
8 |
4 |
16459 |
◊ |
B |
x,y,z |
1_555 |
8 |
4 |
16353 |
54.1 |
-0.3 |
0.511 |
0 |
0 |
0 |
0.000 |
43 |
|
A |
5 |
3 |
16662 |
◊ |
C |
x,y,z-1 |
1_554 |
7 |
3 |
16281 |
37.1 |
0.4 |
0.710 |
0 |
0 |
0 |
0.000 |
Average: |
45.6 |
0.0 |
0.611 |
0 |
0 |
0 |
0.000 |
19 |
44 |
|
A |
6 |
1 |
16662 |
◊ |
E |
x-1,y-1,z-1 |
1_444 |
5 |
1 |
15639 |
50.3 |
-0.0 |
0.572 |
0 |
0 |
0 |
0.000 |
45 |
|
F |
6 |
2 |
15710 |
◊ |
D |
x,y-1,z-1 |
1_544 |
6 |
1 |
16459 |
49.2 |
0.5 |
0.738 |
0 |
0 |
0 |
0.000 |
Average: |
49.8 |
0.2 |
0.655 |
0 |
0 |
0 |
0.000 |
20 |
46 |
|
[ZN]B:2002 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
3 |
16353 |
43.4 |
-31.6 |
0.000 |
0 |
0 |
0 |
0.574 |
47 |
|
[ZN]D:2002 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
8 |
4 |
16459 |
43.1 |
-32.2 |
0.000 |
0 |
0 |
0 |
0.574 |
48 |
|
[ZN]C:2002 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
6 |
3 |
16281 |
43.1 |
-32.0 |
0.000 |
0 |
0 |
0 |
0.574 |
49 |
|
[ZN]A:2002 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
16662 |
42.6 |
-31.5 |
0.000 |
0 |
0 |
0 |
0.574 |
50 |
|
[ZN]F:2002 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
7 |
5 |
15710 |
42.6 |
-31.3 |
0.000 |
0 |
0 |
0 |
0.574 |
51 |
|
[ZN]E:2002 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
6 |
3 |
15639 |
42.4 |
-31.3 |
0.000 |
0 |
0 |
0 |
0.574 |
Average: |
42.9 |
-31.7 |
0.000 |
0 |
0 |
0 |
0.574 |
21 |
52 |
|
[MG]A:2003 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
6 |
2 |
16662 |
41.2 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.044 |
53 |
|
[MG]D:2003 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
4 |
2 |
16459 |
40.7 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.044 |
Average: |
40.9 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.044 |
22 |
54 |
|
[MG]D:2003 |
1 |
1 |
98 |
◊ |
E |
x,y,z |
1_555 |
8 |
6 |
15639 |
35.0 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.000 |
55 |
|
F |
8 |
6 |
15710 |
◊ |
[MG]A:2003 |
x-1,y,z |
1_455 |
1 |
1 |
98 |
32.9 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
33.9 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.000 |
23 |
56 |
|
[ZN]F:2002 |
1 |
1 |
98 |
f |
[MG]F:2001 |
x,y,z |
1_555 |
1 |
1 |
98 |
13.8 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.059 |
24 |
57 |
|
[ZN]A:2002 |
1 |
1 |
98 |
f |
[MG]A:2001 |
x,y,z |
1_555 |
1 |
1 |
98 |
13.3 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.056 |
25 |
58 |
|
[ZN]C:2002 |
1 |
1 |
98 |
f |
[MG]C:2001 |
x,y,z |
1_555 |
1 |
1 |
98 |
13.2 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.058 |
26 |
59 |
|
[ZN]E:2002 |
1 |
1 |
98 |
f |
[MG]E:2001 |
x,y,z |
1_555 |
1 |
1 |
98 |
13.0 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.055 |
27 |
60 |
|
[ZN]D:2002 |
1 |
1 |
98 |
f |
[MG]D:2001 |
x,y,z |
1_555 |
1 |
1 |
98 |
12.9 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.055 |
28 |
61 |
|
[ZN]B:2002 |
1 |
1 |
98 |
f |
[MG]B:2001 |
x,y,z |
1_555 |
1 |
1 |
98 |
12.6 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.055 |
29 |
62 |
|
[87R]F:2003 |
2 |
1 |
579 |
f |
[MG]F:2001 |
x,y,z |
1_555 |
1 |
1 |
98 |
7.9 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.014 |
63 |
|
[87R]B:2003 |
3 |
1 |
579 |
f |
[MG]B:2001 |
x,y,z |
1_555 |
1 |
1 |
98 |
7.6 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.014 |
64 |
|
[87R]E:2003 |
2 |
1 |
577 |
f |
[MG]E:2001 |
x,y,z |
1_555 |
1 |
1 |
98 |
7.5 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.014 |
65 |
|
[87R]C:2003 |
2 |
1 |
577 |
f |
[MG]C:2001 |
x,y,z |
1_555 |
1 |
1 |
98 |
7.3 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.014 |
66 |
|
[87R]D:2004 |
2 |
1 |
578 |
f |
[MG]D:2001 |
x,y,z |
1_555 |
1 |
1 |
98 |
5.8 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.014 |
67 |
|
[87R]A:2004 |
2 |
1 |
576 |
f |
[MG]A:2001 |
x,y,z |
1_555 |
1 |
1 |
98 |
4.9 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.014 |
Average: |
6.8 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.014 |
30 |
68 |
|
[87R]E:2003 |
2 |
1 |
577 |
f |
[ZN]E:2002 |
x,y,z |
1_555 |
1 |
1 |
98 |
7.7 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.047 |
69 |
|
[87R]D:2004 |
2 |
1 |
578 |
f |
[ZN]D:2002 |
x,y,z |
1_555 |
1 |
1 |
98 |
7.0 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.047 |
70 |
|
[87R]B:2003 |
1 |
1 |
579 |
f |
[ZN]B:2002 |
x,y,z |
1_555 |
1 |
1 |
98 |
6.8 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.047 |
71 |
|
[87R]F:2003 |
1 |
1 |
579 |
f |
[ZN]F:2002 |
x,y,z |
1_555 |
1 |
1 |
98 |
6.7 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.047 |
72 |
|
[87R]A:2004 |
1 |
1 |
576 |
f |
[ZN]A:2002 |
x,y,z |
1_555 |
1 |
1 |
98 |
6.6 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.047 |
73 |
|
[87R]C:2003 |
1 |
1 |
577 |
f |
[ZN]C:2002 |
x,y,z |
1_555 |
1 |
1 |
98 |
5.2 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.047 |
Average: |
6.7 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.047 |
31 |
74 |
|
A |
2 |
1 |
16662 |
◊ |
E |
x,y-1,z-1 |
1_544 |
2 |
1 |
15639 |
5.7 |
0.1 |
0.701 |
0 |
0 |
0 |
0.000 |
|