Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "62fc16d54a343d51b244d99594ed2dec",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 30.804,
"b": 81.745,
"c": 32.279,
"alpha": 90.00,
"beta": 118.14,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [81.745,1.400],
"number_observations": 88448,
"number_observations_unique": 26772,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "I/SigI",
"value": 11.900
},
{
"type": "Completeness",
"value": 96.700
},
{
"type": "Redundancy",
"value": 3.300
}
]
},
"refln_shells": [
{
"resolution_limits": [1.405,1.400],
"number_observations": 812,
"number_observations_unique": 246,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.433
},
{
"type": "Completeness",
"value": 92.800
},
{
"type": "Redundancy",
"value": 3.300
}
]
},
{
"resolution_limits": [81.745,6.497],
"number_observations": 842,
"number_observations_unique": 273,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "Completeness",
"value": 95.500
},
{
"type": "Redundancy",
"value": 3.100
}
]
}
]
}