Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "0a3cc66878c7762b8929b893e354c2d7",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 83.34,
"b": 92.62,
"c": 118.26,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.90000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [100.00,2.00],
"number_observations_unique": 57467,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.075
},
{
"type": "I/SigI",
"value": 15.59
},
{
"type": "Completeness",
"value": 92.4
},
{
"type": "Redundancy",
"value": 3.20
}
]
},
"refln_shells": [
{
"resolution_limits": [2.07,2.00],
"number_observations_unique": 4480,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.415
},
{
"type": "Completeness",
"value": 72.9
},
{
"type": "Redundancy",
"value": 2.1
}
]
},
{
"resolution_limits": [2.15,2.07],
"number_observations_unique": 5160,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.383
},
{
"type": "Completeness",
"value": 84.1
},
{
"type": "Redundancy",
"value": 2.4
}
]
},
{
"resolution_limits": [2.25,2.15],
"number_observations_unique": 5576,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.343
},
{
"type": "Completeness",
"value": 91.0
},
{
"type": "Redundancy",
"value": 2.7
}
]
},
{
"resolution_limits": [2.37,2.25],
"number_observations_unique": 5844,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.303
},
{
"type": "Completeness",
"value": 94.8
},
{
"type": "Redundancy",
"value": 2.9
}
]
},
{
"resolution_limits": [2.52,2.37],
"number_observations_unique": 5995,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.251
},
{
"type": "Completeness",
"value": 97.3
},
{
"type": "Redundancy",
"value": 3.2
}
]
},
{
"resolution_limits": [2.71,2.52],
"number_observations_unique": 6111,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.197
},
{
"type": "Completeness",
"value": 98.9
},
{
"type": "Redundancy",
"value": 3.5
}
]
},
{
"resolution_limits": [2.99,2.71],
"number_observations_unique": 6127,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.136
},
{
"type": "Completeness",
"value": 98.7
},
{
"type": "Redundancy",
"value": 3.6
}
]
},
{
"resolution_limits": [3.42,2.99],
"number_observations_unique": 6113,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.076
},
{
"type": "Completeness",
"value": 98.2
},
{
"type": "Redundancy",
"value": 3.7
}
]
},
{
"resolution_limits": [4.31,3.42],
"number_observations_unique": 6103,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "Completeness",
"value": 96.7
},
{
"type": "Redundancy",
"value": 3.6
}
]
},
{
"resolution_limits": [100.00,4.31],
"number_observations_unique": 5958,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "Completeness",
"value": 91.0
},
{
"type": "Redundancy",
"value": 3.6
}
]
}
]
}