| ## |
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 |
|
G |
382 |
105 |
17783 |
◊ |
F |
x,y,z |
1_555 |
388 |
99 |
29651 |
3935.9 |
-95.8 |
0.004 |
9 |
1 |
0 |
1.000 |
| 2 |
2 |
|
F |
220 |
65 |
29651 |
◊ |
E |
x,y,z |
1_555 |
202 |
70 |
16459 |
1945.1 |
-0.9 |
0.888 |
28 |
11 |
0 |
0.126 |
| 3 |
3 |
|
B |
191 |
59 |
17386 |
◊ |
A |
x,y,z |
1_555 |
196 |
62 |
17877 |
1804.7 |
-13.3 |
0.193 |
16 |
7 |
0 |
0.266 |
| 4 |
4 |
|
A |
107 |
30 |
17877 |
◊ |
G |
x,y,z |
1_555 |
100 |
27 |
17783 |
1016.4 |
-13.0 |
0.125 |
10 |
3 |
0 |
0.135 |
| 5 |
5 |
|
G |
105 |
33 |
17783 |
◊ |
E |
x,y,z |
1_555 |
129 |
36 |
16459 |
1010.2 |
-3.8 |
0.620 |
10 |
3 |
0 |
0.073 |
| 6 |
6 |
|
B |
77 |
23 |
17386 |
◊ |
F |
x,y,z |
1_555 |
75 |
17 |
29651 |
770.0 |
-12.3 |
0.085 |
5 |
5 |
0 |
0.075 |
| 7 |
7 |
|
[PGV]F:4001 |
50 |
1 |
1215 |
f |
F |
x,y,z |
1_555 |
88 |
25 |
29651 |
719.3 |
-10.0 |
0.284 |
3 |
0 |
0 |
0.127 |
| 8 |
8 |
|
F |
63 |
22 |
29651 |
◊ |
A |
x-1,y+1,z+1 |
1_466 |
59 |
16 |
17877 |
593.7 |
-2.0 |
0.479 |
9 |
1 |
0 |
0.000 |
| 9 |
9 |
|
[PGV]F:4010 |
17 |
1 |
568 |
◊ |
F |
x,y,z |
1_555 |
35 |
13 |
29651 |
295.1 |
1.6 |
0.421 |
0 |
0 |
0 |
0.000 |
| 10 |
10 |
|
[MAL]F:2000 |
23 |
1 |
462 |
◊ |
F |
x,y,z |
1_555 |
43 |
15 |
29651 |
295.0 |
1.4 |
0.629 |
3 |
0 |
0 |
0.000 |
| 11 |
11 |
|
[UMQ]F:5004 |
17 |
1 |
772 |
f |
E |
x,y,z |
1_555 |
40 |
11 |
16459 |
272.8 |
-8.5 |
0.346 |
0 |
0 |
0 |
0.100 |
| 12 |
12 |
|
F |
24 |
7 |
29651 |
◊ |
B |
x-1,y,z+1 |
1_456 |
30 |
8 |
17386 |
259.4 |
0.1 |
0.745 |
1 |
0 |
0 |
0.000 |
| 13 |
13 |
|
E |
24 |
7 |
16459 |
◊ |
A |
x-1,y+1,z |
1_465 |
28 |
11 |
17877 |
254.9 |
5.4 |
0.958 |
6 |
4 |
0 |
0.000 |
| 14 |
14 |
|
[ADP]A:2501 |
24 |
1 |
563 |
f |
A |
x,y,z |
1_555 |
39 |
14 |
17877 |
248.8 |
-5.3 |
0.494 |
13 |
0 |
0 |
0.275 |
15 |
|
[ADP]B:2502 |
25 |
1 |
567 |
f |
B |
x,y,z |
1_555 |
36 |
13 |
17386 |
232.8 |
-6.2 |
0.462 |
11 |
0 |
0 |
0.275 |
| Average: |
240.8 |
-5.8 |
0.478 |
12 |
0 |
0 |
0.275 |
| 15 |
16 |
|
[PGV]G:4009 |
12 |
1 |
486 |
f |
G |
x,y,z |
1_555 |
29 |
13 |
17783 |
243.1 |
0.9 |
0.343 |
0 |
0 |
0 |
0.000 |
| 16 |
17 |
|
[PGV]G:4006 |
14 |
1 |
514 |
f |
G |
x,y,z |
1_555 |
35 |
9 |
17783 |
207.6 |
-0.9 |
0.238 |
0 |
0 |
0 |
0.010 |
| 17 |
18 |
|
[PGV]F:4001 |
19 |
1 |
1215 |
◊ |
G |
x,y,z |
1_555 |
28 |
7 |
17783 |
189.8 |
2.4 |
0.866 |
2 |
0 |
0 |
0.000 |
| 18 |
19 |
|
[PGV]G:4004 |
12 |
1 |
431 |
f |
G |
x,y,z |
1_555 |
30 |
9 |
17783 |
183.9 |
0.6 |
0.211 |
0 |
0 |
0 |
0.000 |
| 19 |
20 |
|
B |
29 |
10 |
17386 |
◊ |
G |
x,y,z |
1_555 |
18 |
4 |
17783 |
175.3 |
0.1 |
0.759 |
3 |
0 |
0 |
0.006 |
| 20 |
21 |
|
E |
20 |
7 |
16459 |
◊ |
A |
x-1,y+1,z+1 |
1_466 |
17 |
8 |
17877 |
166.1 |
1.1 |
0.656 |
2 |
1 |
0 |
0.000 |
| 21 |
22 |
|
[ADP]B:2502 |
20 |
1 |
567 |
◊ |
A |
x,y,z |
1_555 |
26 |
10 |
17877 |
164.0 |
-1.7 |
0.631 |
2 |
0 |
0 |
0.071 |
23 |
|
[ADP]A:2501 |
20 |
1 |
563 |
◊ |
B |
x,y,z |
1_555 |
27 |
9 |
17386 |
156.3 |
-2.2 |
0.583 |
2 |
0 |
0 |
0.071 |
| Average: |
160.1 |
-2.0 |
0.607 |
2 |
0 |
0 |
0.071 |
| 22 |
24 |
|
[PGV]G:4005 |
12 |
1 |
432 |
f |
G |
x,y,z |
1_555 |
19 |
7 |
17783 |
161.1 |
1.1 |
0.188 |
0 |
0 |
0 |
0.000 |
| 23 |
25 |
|
[PGV]G:4003 |
11 |
1 |
485 |
f |
G |
x,y,z |
1_555 |
23 |
8 |
17783 |
152.1 |
-1.2 |
0.188 |
0 |
0 |
0 |
0.014 |
| 24 |
26 |
|
[UMQ]F:5004 |
16 |
1 |
772 |
◊ |
F |
x,y,z |
1_555 |
19 |
6 |
29651 |
151.3 |
2.4 |
0.936 |
1 |
0 |
0 |
0.000 |
| 25 |
27 |
|
[PGV]F:4002 |
9 |
1 |
353 |
◊ |
F |
x,y,z |
1_555 |
24 |
6 |
29651 |
148.0 |
5.2 |
0.876 |
0 |
0 |
0 |
0.000 |
| 26 |
28 |
|
[UMQ]F:5004 |
11 |
1 |
772 |
◊ |
A |
x-1,y+1,z+1 |
1_466 |
13 |
3 |
17877 |
104.0 |
1.2 |
0.684 |
1 |
0 |
0 |
0.000 |
| 27 |
29 |
|
[PGV]F:4002 |
6 |
1 |
353 |
f |
G |
x,y,z |
1_555 |
14 |
4 |
17783 |
96.2 |
2.2 |
0.728 |
0 |
0 |
0 |
0.000 |
| 28 |
30 |
|
[PGV]F:4008 |
6 |
1 |
327 |
f |
F |
x,y,z |
1_555 |
11 |
6 |
29651 |
86.8 |
1.8 |
0.665 |
0 |
0 |
0 |
0.000 |
| 29 |
31 |
|
[PGV]G:4007 |
11 |
1 |
431 |
f |
[PGV]G:4006 |
x,y,z |
1_555 |
11 |
1 |
514 |
86.0 |
2.3 |
0.056 |
0 |
0 |
0 |
0.000 |
| 30 |
32 |
|
[PGV]G:4004 |
6 |
1 |
431 |
f |
[PGV]G:4003 |
x,y,z |
1_555 |
12 |
1 |
485 |
85.8 |
2.1 |
0.085 |
0 |
0 |
0 |
0.000 |
| 31 |
33 |
|
[ALF]A:3001 |
5 |
1 |
208 |
f |
A |
x,y,z |
1_555 |
18 |
9 |
17877 |
83.1 |
1.4 |
0.399 |
7 |
0 |
0 |
0.040 |
34 |
|
[ALF]B:3002 |
5 |
1 |
208 |
f |
B |
x,y,z |
1_555 |
18 |
7 |
17386 |
81.3 |
2.0 |
0.444 |
8 |
0 |
0 |
0.040 |
| Average: |
82.2 |
1.7 |
0.421 |
8 |
0 |
0 |
0.040 |
| 32 |
35 |
|
[PGV]G:4007 |
9 |
1 |
431 |
f |
G |
x,y,z |
1_555 |
12 |
2 |
17783 |
81.0 |
1.7 |
0.265 |
0 |
0 |
0 |
0.000 |
| 33 |
36 |
|
[PGV]F:4008 |
8 |
1 |
327 |
◊ |
[PGV]F:4002 |
x,y,z |
1_555 |
7 |
1 |
353 |
68.0 |
4.5 |
1.000 |
0 |
0 |
0 |
0.000 |
| 34 |
37 |
|
[ALF]B:3002 |
5 |
1 |
208 |
◊ |
A |
x,y,z |
1_555 |
15 |
8 |
17877 |
52.4 |
0.8 |
0.401 |
3 |
0 |
0 |
0.014 |
38 |
|
[ALF]A:3001 |
5 |
1 |
208 |
◊ |
B |
x,y,z |
1_555 |
13 |
8 |
17386 |
50.9 |
0.8 |
0.404 |
3 |
0 |
0 |
0.014 |
| Average: |
51.6 |
0.8 |
0.402 |
3 |
0 |
0 |
0.014 |
| 35 |
39 |
|
[ALF]A:3001 |
5 |
1 |
208 |
f |
[ADP]A:2501 |
x,y,z |
1_555 |
5 |
1 |
563 |
45.1 |
-2.5 |
0.117 |
1 |
0 |
0 |
0.069 |
40 |
|
[ALF]B:3002 |
5 |
1 |
208 |
f |
[ADP]B:2502 |
x,y,z |
1_555 |
5 |
1 |
567 |
44.6 |
-2.6 |
0.116 |
0 |
0 |
0 |
0.069 |
| Average: |
44.8 |
-2.6 |
0.116 |
1 |
0 |
0 |
0.069 |
| 36 |
41 |
|
[MG]A:1501 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
17877 |
32.3 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.101 |
42 |
|
[MG]B:1502 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
17386 |
31.7 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.101 |
| Average: |
32.0 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.101 |
| 37 |
43 |
|
[MAL]F:2000 |
5 |
1 |
462 |
f |
G |
x,y,z |
1_555 |
4 |
3 |
17783 |
29.8 |
-0.6 |
0.349 |
0 |
0 |
0 |
0.007 |
| 38 |
44 |
|
[ADP]A:2501 |
4 |
1 |
563 |
f |
[MG]A:1501 |
x,y,z |
1_555 |
1 |
1 |
98 |
25.9 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.090 |
45 |
|
[ADP]B:2502 |
4 |
1 |
567 |
f |
[MG]B:1502 |
x,y,z |
1_555 |
1 |
1 |
98 |
25.5 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.090 |
| Average: |
25.7 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.090 |
| 39 |
46 |
|
[ALF]B:3002 |
3 |
1 |
208 |
f |
[MG]B:1502 |
x,y,z |
1_555 |
1 |
1 |
98 |
21.5 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.051 |
47 |
|
[ALF]A:3001 |
3 |
1 |
208 |
f |
[MG]A:1501 |
x,y,z |
1_555 |
1 |
1 |
98 |
21.1 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.051 |
| Average: |
21.3 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.051 |
| 40 |
48 |
|
[PGV]G:4005 |
2 |
1 |
432 |
f |
[PGV]G:4004 |
x,y,z |
1_555 |
4 |
1 |
431 |
20.6 |
-0.3 |
0.097 |
0 |
0 |
0 |
0.003 |
| 41 |
49 |
|
[PGV]F:4010 |
1 |
1 |
568 |
f |
G |
x,y,z |
1_555 |
2 |
1 |
17783 |
10.4 |
-0.3 |
0.469 |
0 |
0 |
0 |
0.004 |
| 42 |
50 |
|
[MG]B:1502 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
17877 |
10.2 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.023 |
51 |
|
[MG]A:1501 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
4 |
3 |
17386 |
9.8 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.023 |
| Average: |
10.0 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.023 |
| 43 |
52 |
|
[PGV]G:4009 |
1 |
1 |
486 |
f |
[PGV]F:4002 |
x,y,z |
1_555 |
1 |
1 |
353 |
2.5 |
0.0 |
0.598 |
0 |
0 |
0 |
0.000 |
| 44 |
53 |
|
[PGV]F:4010 |
1 |
1 |
568 |
◊ |
[PGV]F:4001 |
x,y,z |
1_555 |
1 |
1 |
1215 |
2.5 |
-0.1 |
0.490 |
0 |
0 |
0 |
0.000 |
|