Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4a74b1cdb19caa2c6f03abada4996329",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 18.81,
"b": 20.32,
"c": 75.12,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97947],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30.00,0.98],
"number_observations_unique": 16514,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "I/SigI",
"value": 27
},
{
"type": "Completeness",
"value": 95.2
},
{
"type": "Redundancy",
"value": 6.10
}
]
},
"refln_shells": [
{
"resolution_limits": [1.02,0.98],
"number_observations_unique": 1180,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.209
},
{
"type": "Completeness",
"value": 69.5
},
{
"type": "Redundancy",
"value": 2.7
}
]
},
{
"resolution_limits": [1.06,1.02],
"number_observations_unique": 1449,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.182
},
{
"type": "Completeness",
"value": 86.2
},
{
"type": "Redundancy",
"value": 4.1
}
]
},
{
"resolution_limits": [1.10,1.06],
"number_observations_unique": 1678,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.153
},
{
"type": "Completeness",
"value": 98.5
},
{
"type": "Redundancy",
"value": 6.1
}
]
},
{
"resolution_limits": [1.16,1.10],
"number_observations_unique": 1679,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.121
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 6.5
}
]
},
{
"resolution_limits": [1.23,1.16],
"number_observations_unique": 1702,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.105
},
{
"type": "Completeness",
"value": 99.3
},
{
"type": "Redundancy",
"value": 6.6
}
]
},
{
"resolution_limits": [1.33,1.23],
"number_observations_unique": 1722,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.095
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 6.6
}
]
},
{
"resolution_limits": [1.46,1.33],
"number_observations_unique": 1728,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 6.7
}
]
},
{
"resolution_limits": [1.68,1.46],
"number_observations_unique": 1725,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.088
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 6.8
}
]
},
{
"resolution_limits": [2.11,1.68],
"number_observations_unique": 1782,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 6.9
}
]
},
{
"resolution_limits": [30.00,2.11],
"number_observations_unique": 1869,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "Completeness",
"value": 98.7
},
{
"type": "Redundancy",
"value": 6.4
}
]
}
]
}