Table 8. Bond distances (Å) and angles (°) for the zinc complexes in the superposed structures.
PDB code | Zn—His94 | Zn—His96 | Zn—His119 | Zn—ligand | His94—Zn—His96 | His94—Zn—His119 | His94—Zn—ligand | His96—Zn—His119 | His96—Zn—ligand | His119—Zn—ligand |
---|---|---|---|---|---|---|---|---|---|---|
1moo | 2.15 | 2.08 | 2.10 | 1.81 | 97.4 | 107.9 | 96.0 | 97.6 | 128.0 | 125.1 |
2eu2 | 2.02 | — | 2.07 | 2.01 | — | 112.4 | 112.7 | — | — | 114.7 |
2foq | 2.00 | 2.08 | 2.04 | 2.01 | 103.5 | 113.9 | 111.5 | 98.3 | 113.0 | 115.4 |
2fos | 2.01 | 2.02 | 2.02 | 1.97 | 104.2 | 112.9 | 109.4 | 99.4 | 114.3 | 115.7 |
2fou | 2.00 | 2.00 | 2.03 | 1.93 | 104.2 | 111.9 | 111.2 | 98.6 | 113.9 | 115.8 |
2fov | 2.00 | 2.05 | 2.05 | 1.94 | 104.7 | 112.0 | 111.1 | 98.4 | 113.2 | 116.4 |
2ili | 1.99 | 2.00 | 2.00 | 1.88 | 105.0 | 115.1 | 104.8 | 99.5 | 116.8 | 115.6 |
2nng | 1.99 | 2.03 | 2.04 | 1.93 | 105.0 | 112.9 | 110.1 | 97.5 | 112.7 | 117.4 |
2nno | 1.98 | 2.02 | 2.01 | 1.95 | 103.8 | 112.1 | 111.2 | 99.3 | 113.3 | 116.0 |
2nns | 2.00 | 2.05 | 2.02 | 1.90 | 103.5 | 111.9 | 111.4 | 98.3 | 114.8 | 115.6 |
2nnv | 1.99 | 2.00 | 2.03 | 1.92 | 102.6 | 111.7 | 112.4 | 98.7 | 113.7 | 116.2 |
3d92 | 1.99 | 2.04 | 2.05 | 1.92 | 105.2 | 115.5 | 113.5 | 99.8 | 110.2 | 111.5 |
3k34 | 1.97 | 2.02 | 2.01 | 1.94 | 103.2 | 113.2 | 110.4 | 98.8 | 113.9 | 116.1 |
Average/standard deviation (omitting 2eu2; 12 structures)† | ||||||||||
Average | 2.01 | 2.03 | 2.03 | 1.93 | 103.5 | 112.6 | 109.4 | 98.7 | 114.8 | 116.4 |
Standard deviation | 0.05 | 0.03 | 0.03 | 0.05 | 2.0 | 1.8 | 4.7 | 0.7 | 4.4 | 3.1 |
Average/standard deviation (omitting 2eu2, 1moo; 11 structures)†‡ | ||||||||||
Average | 1.99 | 2.03 | 2.03 | 1.94 | 104.1 | 113.0 | 110.6 | 98.8 | 113.6 | 115.6 |
Standard deviation | 0.01 | 0.02 | 0.02 | 0.04 | 0.8 | 1.3 | 2.2 | 0.7 | 1.6 | 1.5 |
Average/standard deviation (nitrogen ligands; nine structures)†‡§ | ||||||||||
Average | 1.99 | 2.03 | 2.03 | 1.94 | 103.9 | 112.5 | 111.0 | 98.6 | 113.6 | 116.1 |
Standard deviation | 0.01 | 0.02 | 0.02 | 0.03 | 0.7 | 0.7 | 0.9 | 0.6 | 0.7 | 0.6 |