Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6a17246dd440dcaf4e17dca67998c63f",
"space_group_name": "I 4",
"unit_cell": {
"a": 33.185,
"b": 33.185,
"c": 55.283,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.11600],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [28.46,2.070],
"number_observations_unique": 1841,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "I/SigI",
"value": 15.300
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 7.300
}
]
},
"refln_shells": [
{
"resolution_limits": [2.14,2.07],
"number_observations_unique": 194,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.096
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 6.10
}
]
},
{
"resolution_limits": [2.23,2.14],
"number_observations_unique": 184,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.091
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 7.00
}
]
},
{
"resolution_limits": [2.33,2.23],
"number_observations_unique": 169,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.092
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 7.40
}
]
},
{
"resolution_limits": [2.45,2.33],
"number_observations_unique": 195,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.075
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 7.60
}
]
},
{
"resolution_limits": [2.61,2.45],
"number_observations_unique": 176,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 7.40
}
]
},
{
"resolution_limits": [2.81,2.61],
"number_observations_unique": 188,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 7.60
}
]
},
{
"resolution_limits": [3.09,2.81],
"number_observations_unique": 177,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 7.50
}
]
},
{
"resolution_limits": [3.54,3.09],
"number_observations_unique": 187,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 7.50
}
]
},
{
"resolution_limits": [4.46,3.54],
"number_observations_unique": 185,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.04
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 7.50
}
]
},
{
"resolution_limits": [50.00,4.46],
"number_observations_unique": 186,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "Completeness",
"value": 95.90
},
{
"type": "Redundancy",
"value": 7.10
}
]
}
]
}