Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b0c30e89b28936374869ca3c4f1c949e",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 48.397,
"b": 76.851,
"c": 54.544,
"alpha": 90.00,
"beta": 103.81,
"gamma": 90.00
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,2.148],
"number_observations_unique": 21071,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.097
},
{
"type": "I/SigI",
"value": 10.900
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 3.300
}
]
},
"refln_shells": [
{
"resolution_limits": [2.230,2.150],
"number_observations_unique": 2051,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.570
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 2.900
}
]
},
{
"resolution_limits": [2.320,2.230],
"number_observations_unique": 2122,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.508
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 3.200
}
]
},
{
"resolution_limits": [2.420,2.320],
"number_observations_unique": 2109,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.442
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 3.300
}
]
},
{
"resolution_limits": [2.550,2.420],
"number_observations_unique": 2116,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.374
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 3.200
}
]
},
{
"resolution_limits": [2.710,2.550],
"number_observations_unique": 2083,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.290
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 3.200
}
]
},
{
"resolution_limits": [2.920,2.710],
"number_observations_unique": 2092,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.220
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 3.200
}
]
},
{
"resolution_limits": [3.210,2.920],
"number_observations_unique": 2126,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.133
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 3.300
}
]
},
{
"resolution_limits": [3.680,3.210],
"number_observations_unique": 2107,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.074
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 3.600
}
]
},
{
"resolution_limits": [4.630,3.680],
"number_observations_unique": 2112,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 3.600
}
]
},
{
"resolution_limits": [50.000,4.630],
"number_observations_unique": 2153,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 3.500
}
]
}
]
}