## |
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 |
|
F |
173 |
50 |
11139 |
◊ |
E |
x,y,z |
1_555 |
189 |
52 |
11420 |
1669.0 |
-20.1 |
0.100 |
13 |
4 |
0 |
1.000 |
2 |
|
B |
175 |
50 |
10875 |
◊ |
A |
x,y,z |
1_555 |
181 |
51 |
11344 |
1659.8 |
-21.0 |
0.080 |
13 |
5 |
0 |
1.000 |
Average: |
1664.4 |
-20.5 |
0.090 |
13 |
5 |
0 |
1.000 |
2 |
3 |
|
H |
172 |
46 |
10961 |
◊ |
G |
x,y,z |
1_555 |
192 |
52 |
11642 |
1645.7 |
-25.3 |
0.025 |
11 |
4 |
0 |
1.000 |
4 |
|
D |
178 |
50 |
11110 |
◊ |
C |
x,y,z |
1_555 |
188 |
51 |
11490 |
1645.1 |
-25.6 |
0.028 |
11 |
2 |
0 |
1.000 |
Average: |
1645.4 |
-25.4 |
0.027 |
11 |
3 |
0 |
1.000 |
3 |
5 |
|
Y |
51 |
12 |
5358 |
◊ |
F |
x,y,z |
1_555 |
57 |
10 |
11139 |
458.5 |
-5.5 |
0.297 |
4 |
7 |
0 |
0.226 |
6 |
|
X |
53 |
12 |
5262 |
◊ |
B |
x,y,z |
1_555 |
54 |
11 |
10875 |
442.0 |
-5.1 |
0.348 |
7 |
7 |
0 |
0.226 |
Average: |
450.2 |
-5.3 |
0.323 |
6 |
7 |
0 |
0.226 |
4 |
7 |
|
Y |
35 |
13 |
5358 |
◊ |
G |
x,y,z |
1_555 |
47 |
13 |
11642 |
424.9 |
-5.1 |
0.163 |
4 |
3 |
0 |
0.000 |
8 |
|
X |
38 |
15 |
5262 |
◊ |
C |
x,y,z |
1_555 |
44 |
13 |
11490 |
407.6 |
-4.7 |
0.202 |
3 |
2 |
0 |
0.000 |
Average: |
416.2 |
-4.9 |
0.182 |
4 |
3 |
0 |
0.000 |
5 |
9 |
|
X |
42 |
15 |
5262 |
◊ |
D |
x,y,z |
1_555 |
48 |
12 |
11110 |
397.2 |
-3.6 |
0.284 |
5 |
3 |
0 |
0.000 |
10 |
|
Y |
40 |
15 |
5358 |
◊ |
H |
x,y,z |
1_555 |
44 |
11 |
10961 |
373.4 |
-3.3 |
0.311 |
4 |
2 |
0 |
0.000 |
Average: |
385.3 |
-3.4 |
0.298 |
5 |
3 |
0 |
0.000 |
6 |
11 |
|
G |
39 |
15 |
11642 |
◊ |
F |
-x,y-1/2,-z+1 |
2_546 |
41 |
15 |
11139 |
359.7 |
-1.2 |
0.566 |
5 |
0 |
0 |
0.000 |
7 |
12 |
|
A |
36 |
13 |
11344 |
◊ |
C |
x,y,z-1 |
1_554 |
33 |
11 |
11490 |
316.2 |
-2.5 |
0.393 |
2 |
0 |
0 |
0.000 |
8 |
13 |
|
D |
44 |
16 |
11110 |
◊ |
H |
x,y-1,z |
1_545 |
35 |
10 |
10961 |
311.3 |
-1.9 |
0.582 |
2 |
0 |
0 |
0.000 |
14 |
|
H |
43 |
14 |
10961 |
◊ |
D |
x,y,z |
1_555 |
35 |
11 |
11110 |
308.6 |
-1.7 |
0.604 |
2 |
0 |
0 |
0.000 |
Average: |
309.9 |
-1.8 |
0.593 |
2 |
0 |
0 |
0.000 |
9 |
15 |
|
G |
35 |
11 |
11642 |
◊ |
E |
x,y,z-1 |
1_554 |
35 |
14 |
11420 |
291.1 |
-0.6 |
0.597 |
3 |
0 |
0 |
0.000 |
10 |
16 |
|
X |
28 |
8 |
5262 |
◊ |
A |
x,y,z |
1_555 |
36 |
11 |
11344 |
286.7 |
1.2 |
0.722 |
6 |
0 |
0 |
0.007 |
17 |
|
Y |
26 |
8 |
5358 |
◊ |
E |
x,y,z |
1_555 |
35 |
10 |
11420 |
271.1 |
0.6 |
0.689 |
7 |
0 |
0 |
0.007 |
Average: |
278.9 |
0.9 |
0.705 |
7 |
0 |
0 |
0.007 |
11 |
18 |
|
E |
35 |
11 |
11420 |
x |
E |
-x,y-1/2,-z+2 |
2_547 |
32 |
11 |
11420 |
274.9 |
0.2 |
0.662 |
3 |
0 |
0 |
0.000 |
12 |
19 |
|
C |
33 |
11 |
11490 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
27 |
11 |
10875 |
269.9 |
-2.3 |
0.385 |
3 |
1 |
0 |
0.000 |
13 |
20 |
|
E |
35 |
12 |
11420 |
◊ |
G |
-x,y-1/2,-z+1 |
2_546 |
24 |
9 |
11642 |
264.9 |
-1.6 |
0.403 |
2 |
0 |
0 |
0.000 |
14 |
21 |
|
A |
27 |
9 |
11344 |
◊ |
B |
x,y-1,z |
1_545 |
26 |
9 |
10875 |
256.1 |
0.6 |
0.748 |
2 |
0 |
0 |
0.000 |
15 |
22 |
|
A |
24 |
11 |
11344 |
x |
A |
-x+1,y-1/2,-z |
2_645 |
20 |
7 |
11344 |
225.4 |
-1.9 |
0.366 |
4 |
0 |
0 |
0.000 |
16 |
23 |
|
E |
18 |
7 |
11420 |
◊ |
F |
x,y-1,z |
1_545 |
26 |
8 |
11139 |
211.5 |
-1.4 |
0.490 |
2 |
0 |
0 |
0.000 |
17 |
24 |
|
Y |
20 |
9 |
5358 |
◊ |
G |
-x,y-1/2,-z+1 |
2_546 |
21 |
9 |
11642 |
163.4 |
1.7 |
0.769 |
1 |
4 |
0 |
0.000 |
18 |
25 |
|
C |
20 |
7 |
11490 |
x |
C |
-x+1,y-1/2,-z+1 |
2_646 |
21 |
6 |
11490 |
161.5 |
0.3 |
0.636 |
2 |
1 |
0 |
0.000 |
19 |
26 |
|
D |
13 |
6 |
11110 |
x |
D |
x,y-1,z |
1_545 |
16 |
6 |
11110 |
146.2 |
-0.9 |
0.537 |
2 |
0 |
0 |
0.000 |
27 |
|
H |
14 |
5 |
10961 |
x |
H |
x,y-1,z |
1_545 |
11 |
4 |
10961 |
131.3 |
-0.7 |
0.531 |
2 |
0 |
0 |
0.000 |
Average: |
138.7 |
-0.8 |
0.534 |
2 |
0 |
0 |
0.000 |
20 |
28 |
|
B |
18 |
6 |
10875 |
◊ |
F |
x,y,z-1 |
1_554 |
15 |
5 |
11139 |
140.3 |
-2.0 |
0.374 |
1 |
0 |
0 |
0.000 |
21 |
29 |
|
A |
13 |
7 |
11344 |
◊ |
F |
x,y-1,z-1 |
1_544 |
19 |
6 |
11139 |
124.7 |
1.3 |
0.818 |
2 |
0 |
0 |
0.000 |
22 |
30 |
|
A |
15 |
6 |
11344 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
14 |
7 |
11490 |
105.0 |
-0.4 |
0.558 |
2 |
0 |
0 |
0.000 |
23 |
31 |
|
D |
12 |
6 |
11110 |
◊ |
F |
x,y-1,z |
1_545 |
11 |
3 |
11139 |
104.7 |
-0.1 |
0.581 |
1 |
0 |
0 |
0.000 |
24 |
32 |
|
[NAG]X:301 |
8 |
1 |
364 |
cf |
X |
x,y,z |
1_555 |
11 |
3 |
5262 |
92.8 |
3.2 |
0.500 |
0 |
0 |
0 |
0.000 |
25 |
33 |
|
Y |
9 |
4 |
5358 |
◊ |
D |
x,y,z |
1_555 |
10 |
5 |
11110 |
85.8 |
1.1 |
0.793 |
0 |
0 |
0 |
0.000 |
34 |
|
X |
8 |
3 |
5262 |
◊ |
H |
x,y-1,z |
1_545 |
9 |
4 |
10961 |
69.9 |
1.1 |
0.807 |
0 |
0 |
0 |
0.000 |
Average: |
77.9 |
1.1 |
0.800 |
0 |
0 |
0 |
0.000 |
26 |
35 |
|
A |
12 |
5 |
11344 |
x |
A |
x,y-1,z |
1_545 |
11 |
5 |
11344 |
82.9 |
0.1 |
0.646 |
1 |
0 |
0 |
0.000 |
27 |
36 |
|
[NAG]Y:301 |
9 |
1 |
366 |
cf |
Y |
x,y,z |
1_555 |
9 |
4 |
5358 |
79.8 |
2.3 |
0.330 |
0 |
0 |
0 |
0.000 |
28 |
37 |
|
[NAG]Y:302 |
10 |
1 |
369 |
cf |
[NAG]Y:301 |
x,y,z |
1_555 |
6 |
1 |
366 |
76.1 |
2.0 |
0.099 |
1 |
0 |
0 |
0.000 |
29 |
38 |
|
[NAG]X:302 |
9 |
1 |
367 |
cf |
[NAG]X:301 |
x,y,z |
1_555 |
6 |
1 |
364 |
72.6 |
1.9 |
0.105 |
0 |
0 |
0 |
0.000 |
30 |
39 |
|
G |
9 |
3 |
11642 |
◊ |
Y |
-x,y-1/2,-z+1 |
2_546 |
5 |
2 |
5358 |
64.1 |
1.6 |
0.835 |
0 |
0 |
0 |
0.000 |
31 |
40 |
|
B |
9 |
3 |
10875 |
◊ |
F |
x,y-1,z-1 |
1_544 |
7 |
2 |
11139 |
61.9 |
-0.2 |
0.557 |
0 |
1 |
0 |
0.000 |
32 |
41 |
|
B |
8 |
2 |
10875 |
◊ |
E |
x,y,z-1 |
1_554 |
8 |
3 |
11420 |
60.9 |
-0.9 |
0.405 |
0 |
0 |
0 |
0.000 |
33 |
42 |
|
G |
7 |
3 |
11642 |
◊ |
E |
-x,y-1/2,-z+1 |
2_546 |
8 |
3 |
11420 |
50.0 |
0.3 |
0.680 |
0 |
0 |
0 |
0.000 |
34 |
43 |
|
H |
4 |
4 |
10961 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
10875 |
41.6 |
0.5 |
0.475 |
0 |
0 |
0 |
0.000 |
35 |
44 |
|
E |
6 |
3 |
11420 |
x |
E |
x,y-1,z |
1_545 |
5 |
3 |
11420 |
41.2 |
-0.2 |
0.516 |
0 |
0 |
0 |
0.000 |
36 |
45 |
|
[NAG]X:302 |
3 |
1 |
367 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
8 |
3 |
11490 |
39.8 |
0.7 |
0.455 |
0 |
0 |
0 |
0.000 |
37 |
46 |
|
G |
5 |
3 |
11642 |
x |
G |
-x,y-1/2,-z+1 |
2_546 |
12 |
6 |
11642 |
38.5 |
-0.1 |
0.603 |
0 |
0 |
0 |
0.000 |
38 |
47 |
|
[NAG]Y:301 |
2 |
1 |
366 |
◊ |
G |
x,y,z |
1_555 |
5 |
3 |
11642 |
29.2 |
1.4 |
0.735 |
0 |
0 |
0 |
0.000 |
39 |
48 |
|
Y |
5 |
2 |
5358 |
◊ |
F |
x,y-1,z |
1_545 |
4 |
2 |
11139 |
20.9 |
0.2 |
0.626 |
0 |
0 |
0 |
0.000 |
40 |
49 |
|
G |
1 |
1 |
11642 |
◊ |
E |
x,y-1,z-1 |
1_544 |
2 |
1 |
11420 |
19.9 |
0.7 |
0.628 |
0 |
0 |
0 |
0.000 |
41 |
50 |
|
[NAG]Y:302 |
1 |
1 |
369 |
◊ |
G |
x,y,z |
1_555 |
3 |
2 |
11642 |
15.8 |
0.5 |
0.487 |
0 |
0 |
0 |
0.000 |
42 |
51 |
|
X |
1 |
1 |
5262 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
4 |
1 |
11490 |
15.2 |
-0.4 |
0.319 |
0 |
0 |
0 |
0.000 |
43 |
52 |
|
C |
4 |
1 |
11490 |
◊ |
F |
x,y-1,z |
1_545 |
1 |
1 |
11139 |
13.6 |
0.1 |
0.693 |
0 |
0 |
0 |
0.000 |
44 |
53 |
|
G |
3 |
1 |
11642 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
10875 |
12.9 |
0.0 |
0.612 |
0 |
0 |
0 |
0.000 |
45 |
54 |
|
[NAG]X:301 |
2 |
1 |
364 |
◊ |
C |
x,y,z |
1_555 |
2 |
2 |
11490 |
10.2 |
0.4 |
0.416 |
0 |
0 |
0 |
0.000 |
46 |
55 |
|
G |
2 |
1 |
11642 |
◊ |
F |
x,y,z-1 |
1_554 |
1 |
1 |
11139 |
9.4 |
0.2 |
0.742 |
0 |
0 |
0 |
0.000 |
47 |
56 |
|
[NAG]X:302 |
1 |
1 |
367 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
11490 |
3.5 |
0.1 |
0.432 |
0 |
0 |
0 |
0.000 |
48 |
57 |
|
B |
1 |
1 |
10875 |
◊ |
C |
x,y,z-1 |
1_554 |
1 |
1 |
11490 |
1.8 |
0.1 |
0.738 |
0 |
0 |
0 |
0.000 |
|